Methyl (1S,3S,4S,5aS,9S,9aR)-1,4,5,8,9,9a-hexahydro-3,9-dimethyl-8-oxo-3H-1,4:3,5a-dimethano-2-benzoxepin-9-propanoate

CAS Registry Number®

1022904-19-3

CAS Name

Methyl (1S,3S,4S,5aS,9S,9aR)-1,4,5,8,9,9a-hexahydro-3,9-dimethyl-8-oxo-3H-1,4:3,5a-dimethano-2-benzoxepin-9-propanoate

Molecular Formula

C18H24O4

Molecular Mass

304.38

Cite this Page

Methyl (1S,3S,4S,5aS,9S,9aR)-1,4,5,8,9,9a-hexahydro-3,9-dimethyl-8-oxo-3H-1,4:3,5a-dimethano-2-benzoxepin-9-propanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1022904-19-3 (retrieved 2025-01-07) (CAS RN: 1022904-19-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H24O4/c1-16(6-5-14(20)21-3)13(19)4-7-18-9-11-8-12(15(16)18)22-17(11,2)10-18/h4,7,11-12,15H,5-6,8-10H2,1-3H3/t11-,12+,15+,16-,17+,18+/m1/s1

InChIKey

InChIKey=NUIVTFDVMXNHQW-URWOFZPHSA-N

SMILES

C(CC(OC)=O)[C@@]1(C)[C@]2([C@]3(C[C@@]4([C@](C)(C3)O[C@]2(C4)[H])[H])C=CC1=O)[H]

Canonical SMILES

O=C(OC)CCC1(C(=O)C=CC23CC4CC(OC4(C)C2)C31)C

Other Names for this Substance

  • 3H-1,4:3,5a-Dimethano-2-benzoxepin-9-propanoic acid, 1,4,5,8,9,9a-hexahydro-3,9-dimethyl-8-oxo-, methyl ester, (1S,3S,4S,5aS,9S,9aR)-
  • Methyl (1S,3S,4S,5aS,9S,9aR)-1,4,5,8,9,9a-hexahydro-3,9-dimethyl-8-oxo-3H-1,4:3,5a-dimethano-2-benzoxepin-9-propanoate
  • Methyl platensinoate

CAS INSIGHTSTM
A collage showcasing diverse technology, including gadgets, devices, and innovative tools in a vibrant arrangement.