(2′aS)-2′a,3′,4′,5′-Tetrahydro-3′-methylspiro[2,5-cyclohexadiene-1,1′(2′H)-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-one

CAS Registry Number®

1093-07-8

CAS Name

(2′aS)-2′a,3′,4′,5′-Tetrahydro-3′-methylspiro[2,5-cyclohexadiene-1,1′(2′H)-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-one

Molecular Formula

C18H17NO3

Molecular Mass

295.33

Cite this Page

(2′aS)-2′a,3′,4′,5′-Tetrahydro-3′-methylspiro[2,5-cyclohexadiene-1,1′(2′H)-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1093-07-8 (retrieved 2024-11-24) (CAS RN: 1093-07-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    178.5-179.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H17NO3/c1-19-7-4-11-8-14-17(22-10-21-14)16-15(11)13(19)9-18(16)5-2-12(20)3-6-18/h2-3,5-6,8,13H,4,7,9-10H2,1H3/t13-/m0/s1

InChIKey

InChIKey=NMVDXQMYKKNYFO-ZDUSSCGKSA-N

SMILES

CN1[C@]2(CC3(C=4C2=C(C=C5C4OCO5)CC1)C=CC(=O)C=C3)[H]

Canonical SMILES

O=C1C=CC2(C=C1)C=3C=4OCOC4C=C5C3C(N(C)CC5)C2

Other Names for this Substance

  • Spiro[2,5-cyclohexadiene-1,1′(2′H)-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-one, 2′a,3′,4′,5′-tetrahydro-3′-methyl-, (2′aS)-
  • Mecambrine
  • Spiro[2,5-cyclohexadiene-1,1′(2′H)-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-one, 2′a,3′,4′,5′-tetrahydro-3′-methyl-, (S)-
  • (2′aS)-2′a,3′,4′,5′-Tetrahydro-3′-methylspiro[2,5-cyclohexadiene-1,1′(2′H)-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-one
  • Fugapavine

View All

Deleted or Replaced CAS Registry Numbers

13408-22-5, 31065-71-1

CAS INSIGHTSTM
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