Nalmexone

CAS Registry Number®

16676-26-9
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CAS Name

Nalmexone

Molecular Formula

C21H25NO4

Molecular Mass

355.43

Cite this Page

Nalmexone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=16676-26-9 (retrieved 2024-04-25) (CAS RN: 16676-26-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H25NO4/c1-12(2)6-9-22-10-8-20-17-13-3-4-14(23)18(17)26-19(20)15(24)5-7-21(20,25)16(22)11-13/h3-4,6,16,19,23,25H,5,7-11H2,1-2H3/t16-,19+,20+,21-/m1/s1

InChIKey

InChIKey=OHKCLOQPSLQCQR-MBPVOVBZSA-N

SMILES

O[C@]12[C@@]34C=5C(O[C@]3(C(=O)CC1)[H])=C(O)C=CC5C[C@]2(N(CC=C(C)C)CC4)[H]

Canonical SMILES

O=C1CCC2(O)C3N(CC=C(C)C)CCC42C5=C(OC14)C(O)=CC=C5C3

Other Names for this Substance

  • Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(3-methyl-2-buten-1-yl)-, (5α)-
  • Morphinan-6-one, 4,5α-epoxy-3,14-dihydroxy-17-(3-methyl-2-butenyl)-
  • Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(3-methyl-2-butenyl)-, (5α)-
  • (5α)-4,5-Epoxy-3,14-dihydroxy-17-(3-methyl-2-buten-1-yl)morphinan-6-one
  • Nalmexone

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