1,1-Dimethylethyl hexahydro-4-[(5-iodo-1-naphthalenyl)sulfonyl]-1H-1,4-diazepine-1-carboxylate

CAS Registry Number®

1951444-75-9

CAS Name

1,1-Dimethylethyl hexahydro-4-[(5-iodo-1-naphthalenyl)sulfonyl]-1H-1,4-diazepine-1-carboxylate

Molecular Formula

C20H25IN2O4S

Molecular Mass

516.39

Cite this Page

1,1-Dimethylethyl hexahydro-4-[(5-iodo-1-naphthalenyl)sulfonyl]-1H-1,4-diazepine-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1951444-75-9 (retrieved 2024-11-23) (CAS RN: 1951444-75-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H25IN2O4S/c1-20(2,3)27-19(24)22-11-6-12-23(14-13-22)28(25,26)18-10-5-7-15-16(18)8-4-9-17(15)21/h4-5,7-10H,6,11-14H2,1-3H3

InChIKey

InChIKey=ITZUYNVNWPWGHF-UHFFFAOYSA-N

SMILES

S(=O)(=O)(C=1C2=C(C=CC1)C(I)=CC=C2)N3CCN(C(OC(C)(C)C)=O)CCC3

Canonical SMILES

O=C(OC(C)(C)C)N1CCN(CCC1)S(=O)(=O)C=2C=CC=C3C(I)=CC=CC32

Other Names for this Substance

  • 1H-1,4-Diazepine-1-carboxylic acid, hexahydro-4-[(5-iodo-1-naphthalenyl)sulfonyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl hexahydro-4-[(5-iodo-1-naphthalenyl)sulfonyl]-1H-1,4-diazepine-1-carboxylate

CAS INSIGHTSTM
Hourglass and a clock