N,N′,N′′-[(2,4,6-Trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris[methylene(3,5,5-trimethyl-3,1-cyclohexanediyl)]]tris[hexahydro-2-oxo-1H-azepine-1-carboxamide]

CAS Registry Number®

68975-83-7

CAS Name

N,N′,N′′-[(2,4,6-Trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris[methylene(3,5,5-trimethyl-3,1-cyclohexanediyl)]]tris[hexahydro-2-oxo-1H-azepine-1-carboxamide]

Molecular Formula

C54H87N9O9

Molecular Mass

1006.32

Cite this Page

N,N′,N′′-[(2,4,6-Trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris[methylene(3,5,5-trimethyl-3,1-cyclohexanediyl)]]tris[hexahydro-2-oxo-1H-azepine-1-carboxamide].   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68975-83-7 (retrieved 2024-11-25) (CAS RN: 68975-83-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C54H87N9O9/c1-49(2)25-37(55-43(67)58-22-16-10-13-19-40(58)64)28-52(7,31-49)34-61-46(70)62(35-53(8)29-38(26-50(3,4)32-53)56-44(68)59-23-17-11-14-20-41(59)65)48(72)63(47(61)71)36-54(9)30-39(27-51(5,6)33-54)57-45(69)60-24-18-12-15-21-42(60)66/h37-39H,10-36H2,1-9H3,(H,55,67)(H,56,68)(H,57,69)

InChIKey

InChIKey=XAUGVXXNNOTSRJ-UHFFFAOYSA-N

SMILES

C(N1C(=O)N(CC2(C)CC(NC(=O)N3C(=O)CCCCC3)CC(C)(C)C2)C(=O)N(CC4(C)CC(NC(=O)N5C(=O)CCCCC5)CC(C)(C)C4)C1=O)C6(C)CC(NC(=O)N7C(=O)CCCCC7)CC(C)(C)C6

Canonical SMILES

O=C(NC1CC(C)(C)CC(C)(CN2C(=O)N(C(=O)N(C2=O)CC3(C)CC(NC(=O)N4C(=O)CCCCC4)CC(C)(C)C3)CC5(C)CC(NC(=O)N6C(=O)CCCCC6)CC(C)(C)C5)C1)N7C(=O)CCCCC7

Other Names for this Substance

  • 1H-Azepine-1-carboxamide, N,N′,N′′-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris[methylene(3,5,5-trimethyl-3,1-cyclohexanediyl)]]tris[hexahydro-2-oxo-
  • N,N′,N′′-[(2,4,6-Trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris[methylene(3,5,5-trimethyl-3,1-cyclohexanediyl)]]tris[hexahydro-2-oxo-1H-azepine-1-carboxamide]

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