3-[3-[(Hexahydro-1H-azepin-1-yl)methyl]-4-methoxyphenyl]-2-propenoic acid

CAS Registry Number®

1119449-77-2

CAS Name

3-[3-[(Hexahydro-1H-azepin-1-yl)methyl]-4-methoxyphenyl]-2-propenoic acid

Molecular Formula

C17H23NO3

Molecular Mass

289.37

Cite this Page

3-[3-[(Hexahydro-1H-azepin-1-yl)methyl]-4-methoxyphenyl]-2-propenoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1119449-77-2 (retrieved 2024-12-02) (CAS RN: 1119449-77-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H23NO3/c1-21-16-8-6-14(7-9-17(19)20)12-15(16)13-18-10-4-2-3-5-11-18/h6-9,12H,2-5,10-11,13H2,1H3,(H,19,20)

InChIKey

InChIKey=BQSQDVVKCVUZKP-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C=CC1=CC=C(OC)C(=C1)CN2CCCCCC2

Other Names for this Substance

  • 2-Propenoic acid, 3-[3-[(hexahydro-1H-azepin-1-yl)methyl]-4-methoxyphenyl]-
  • 3-[3-[(Hexahydro-1H-azepin-1-yl)methyl]-4-methoxyphenyl]-2-propenoic acid

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