(12aS)-2,3,12,12a-Tetrahydro-6,9,10-trimethoxy-1H-[1]benzoxepino[2,3,4-ij]isoquinoline

CAS Registry Number®

479-42-5

CAS Name

(12aS)-2,3,12,12a-Tetrahydro-6,9,10-trimethoxy-1H-[1]benzoxepino[2,3,4-ij]isoquinoline

Molecular Formula

C19H21NO4

Molecular Mass

327.37

Cite this Page

(12aS)-2,3,12,12a-Tetrahydro-6,9,10-trimethoxy-1H-[1]benzoxepino[2,3,4-ij]isoquinoline.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=479-42-5 (retrieved 2025-01-30) (CAS RN: 479-42-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    102 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H21NO4/c1-21-14-5-4-11-6-7-20-13-8-12-9-16(22-2)17(23-3)10-15(12)24-19(14)18(11)13/h4-5,9-10,13,20H,6-8H2,1-3H3/t13-/m0/s1

InChIKey

InChIKey=KTKYPZQQXSZXCE-ZDUSSCGKSA-N

SMILES

O(C)C1=C2C=3[C@](CC=4C(O2)=CC(OC)=C(OC)C4)(NCCC3C=C1)[H]

Canonical SMILES

O1C2=CC(OC)=C(OC)C=C2CC3NCCC4=CC=C(OC)C1=C43

Other Names for this Substance

  • 1H-[1]Benzoxepino[2,3,4-ij]isoquinoline, 2,3,12,12a-tetrahydro-6,9,10-trimethoxy-, (12aS)-
  • Cularimine
  • 1H-[1]Benzoxepino[2,3,4-ij]isoquinoline, 2,3,12,12a-tetrahydro-6,9,10-trimethoxy-, (S)-
  • (12aS)-2,3,12,12a-Tetrahydro-6,9,10-trimethoxy-1H-[1]benzoxepino[2,3,4-ij]isoquinoline
  • (+)-Cularimine