Methyl hexahydro-1,2-dimethyl-4-phenyl-1H-azepine-4-carboxylate

CAS Registry Number®

469-78-3
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CAS Name

Methyl hexahydro-1,2-dimethyl-4-phenyl-1H-azepine-4-carboxylate

Molecular Formula

C16H23NO2

Molecular Mass

261.36

Cite this Page

Methyl hexahydro-1,2-dimethyl-4-phenyl-1H-azepine-4-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=469-78-3 (retrieved 2024-04-19) (CAS RN: 469-78-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H23NO2/c1-13-12-16(15(18)19-3,10-7-11-17(13)2)14-8-5-4-6-9-14/h4-6,8-9,13H,7,10-12H2,1-3H3

InChIKey

InChIKey=RAAFYFKWMRWOIT-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1(CC(C)N(C)CCC1)C2=CC=CC=C2

Canonical SMILES

O=C(OC)C1(C=2C=CC=CC2)CCCN(C)C(C)C1

Other Names for this Substance

  • 1H-Azepine-4-carboxylic acid, hexahydro-1,2-dimethyl-4-phenyl-, methyl ester
  • Methyl hexahydro-1,2-dimethyl-4-phenyl-1H-azepine-4-carboxylate
  • Hexahydro-1,2-dimethyl-4-phenyl-4-azepinecarboxylic acid methyl ester
  • Metheptazine

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