Ecopipam

CAS Registry Number®

112108-01-7

CAS Name

Ecopipam

Molecular Formula

C19H20ClNO

Molecular Mass

313.82

Cite this Page

Ecopipam.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=112108-01-7 (retrieved 2024-11-21) (CAS RN: 112108-01-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    217-219 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1

InChIKey

InChIKey=DMJWENQHWZZWDF-PKOBYXMFSA-N

SMILES

CN1[C@@]2([C@@](C=3C(=CC(Cl)=C(O)C3)CC1)(C=4C(CC2)=CC=CC4)[H])[H]

Canonical SMILES

ClC=1C=C2C(=CC1O)C3C=4C=CC=CC4CCC3N(C)CC2

Other Names for this Substance

  • 5H-Benzo[d]naphth[2,1-b]azepin-12-ol, 11-chloro-6,6a,7,8,9,13b-hexahydro-7-methyl-, (6aS,13bR)-
  • 5H-Benzo[d]naphth[2,1-b]azepin-12-ol, 11-chloro-6,6a,7,8,9,13b-hexahydro-7-methyl-, (6aS-trans)-
  • (6aS,13bR)-11-Chloro-6,6a,7,8,9,13b-hexahydro-7-methyl-5H-benzo[d]naphth[2,1-b]azepin-12-ol
  • Ecopipam
  • SCH 39166

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration