Capobenate

CAS Registry Number®

27276-25-1

CAS Name

Capobenate

Molecular Formula

C16H23NO6.Na

Molecular Mass

348.35

Cite this Page

Capobenate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=27276-25-1 (retrieved 2025-05-14) (CAS RN: 27276-25-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H23NO6.Na/c1-21-12-9-11(10-13(22-2)15(12)23-3)16(20)17-8-6-4-5-7-14(18)19;/h9-10H,4-8H2,1-3H3,(H,17,20)(H,18,19);

InChIKey

InChIKey=GGUKCLXXWWVTFA-UHFFFAOYSA-N

SMILES

O(C)C1=C(OC)C=C(C(NCCCCCC(O)=O)=O)C=C1OC.[Na]

Canonical SMILES

[Na].O=C(O)CCCCCNC(=O)C1=CC(OC)=C(OC)C(OC)=C1

Other Names for this Substance

  • Hexanoic acid, 6-[(3,4,5-trimethoxybenzoyl)amino]-, sodium salt (1:1)
  • Hexanoic acid, 6-(3,4,5-trimethoxybenzamido)-, monosodium salt
  • Hexanoic acid, 6-[(3,4,5-trimethoxybenzoyl)amino]-, monosodium salt
  • Capobenate sodium
  • Sodium 6-(3,4,5-trimethoxybenzamido)hexanoate

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