3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxybenzoic acid

CAS Registry Number®

299181-35-4
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CAS Name

3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxybenzoic acid

Molecular Formula

C14H19NO5S

Molecular Mass

313.37

Cite this Page

3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxybenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=299181-35-4 (retrieved 2024-08-21) (CAS RN: 299181-35-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H19NO5S/c1-20-12-7-6-11(14(16)17)10-13(12)21(18,19)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3,(H,16,17)

InChIKey

InChIKey=SSIIBIGRHVVLAP-UHFFFAOYSA-N

SMILES

S(=O)(=O)(C1=C(OC)C=CC(C(O)=O)=C1)N2CCCCCC2

Canonical SMILES

O=C(O)C1=CC=C(OC)C(=C1)S(=O)(=O)N2CCCCCC2

Other Names for this Substance

  • Benzoic acid, 3-[(hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxy-
  • 3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxybenzoic acid