Vobasan-17-oic acid, 3-oxo-, methyl ester

CAS Registry Number®

2134-83-0

CAS Name

Vobasan-17-oic acid, 3-oxo-, methyl ester

Molecular Formula

C21H24N2O3

Molecular Mass

352.43

Cite this Page

Vobasan-17-oic acid, 3-oxo-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2134-83-0 (retrieved 2024-11-30) (CAS RN: 2134-83-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    111-113 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H24N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h4-8,14,17,19,22H,9-11H2,1-3H3/b12-4-/t14-,17-,19-/m0/s1

InChIKey

InChIKey=TYPMTMPLTVSOBU-XJHWFDBESA-N

SMILES

O=C1C2=C(C=3C(N2)=CC=CC3)C[C@]4([C@@H](C(OC)=O)[C@@](C1)(/C(=C\C)/CN4C)[H])[H]

Canonical SMILES

O=C(OC)C1C2C(=CC)CN(C)C1CC=3C=4C=CC=CC4NC3C(=O)C2

Other Names for this Substance

  • Vobasan-17-oic acid, 3-oxo-, methyl ester
  • Vobasine
  • 2,6-Methano-1H-azecino[5,4-b]indole, vobasan-17-oic acid deriv.
  • (-)-Vobasine
  • Vobasin

View All

Deleted or Replaced CAS Registry Numbers

28639-08-9

CAS INSIGHTSTM
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