(5S,12S)-5,6,12,13-Tetrahydro-15-methylcycloocta[1,2-f:5,6-f′]bis[1,3]benzodioxol-5,12-imine

CAS Registry Number®

4040-75-9

CAS Name

(5S,12S)-5,6,12,13-Tetrahydro-15-methylcycloocta[1,2-f:5,6-f′]bis[1,3]benzodioxol-5,12-imine

Molecular Formula

C19H17NO4

Molecular Mass

323.34

Cite this Page

(5S,12S)-5,6,12,13-Tetrahydro-15-methylcycloocta[1,2-f:5,6-f′]bis[1,3]benzodioxol-5,12-imine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4040-75-9 (retrieved 2024-11-26) (CAS RN: 4040-75-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    127-128 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H17NO4/c1-20-14-2-10-4-16-18(23-8-21-16)6-12(10)15(20)3-11-5-17-19(7-13(11)14)24-9-22-17/h4-7,14-15H,2-3,8-9H2,1H3/t14-,15-/m0/s1

InChIKey

InChIKey=PGINMPJZCWDQNT-GJZGRUSLSA-N

SMILES

CN1[C@@]2(C=3C(C[C@]1(C=4C(C2)=CC5=C(C4)OCO5)[H])=CC6=C(C3)OCO6)[H]

Canonical SMILES

O1C=2C=C3C(=CC2OC1)C4N(C)C(C5=CC=6OCOC6C=C5C4)C3

Other Names for this Substance

  • Cycloocta[1,2-f:5,6-f′]bis[1,3]benzodioxol-5,12-imine, 5,6,12,13-tetrahydro-15-methyl-, (5S,12S)-
  • Eschscholtzine
  • Cycloocta[1,2-f:5,6-f′]bis[1,3]benzodioxol-5,12-imine, 5,6,12,13-tetrahydro-15-methyl-, (5S)-
  • (5S,12S)-5,6,12,13-Tetrahydro-15-methylcycloocta[1,2-f:5,6-f′]bis[1,3]benzodioxol-5,12-imine
  • Crychine

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Deleted or Replaced CAS Registry Numbers

58657-91-3

CAS INSIGHTSTM
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