CAS Registry Number®
73232-52-7
CAS Name
Methylnaltrexone bromide
Molecular Formula
C21H26NO4.Br
Other Names and Identifiers
InChI
InChI=1S/C21H25NO4.BrH/c1-22(11-12-2-3-12)9-8-20-17-13-4-5-14(23)18(17)26-19(20)15(24)6-7-21(20,25)16(22)10-13;/h4-5,12,16,19,25H,2-3,6-11H2,1H3;1H/t16-,19+,20+,21-,22?;/m1./s1
InChIKey
InChIKey=IFGIYSGOEZJNBE-KNLJMPJLSA-N
SMILES
O[C@]12[C@@]34C=5C(O[C@]3(C(=O)CC1)[H])=C(O)C=CC5C[C@]2([N+](CC6CC6)(C)CC4)[H].[Br-]
Canonical SMILES
[Br-].O=C1CCC2(O)C3CC4=CC=C(O)C=5OC1C2(C54)CC[N+]3(C)CC6CC6
Other Names for this Substance
- Morphinanium, 17-(cyclopropylmethyl)-4,5-epoxy-3,14-dihydroxy-17-methyl-6-oxo-, bromide (1:1), (5α)-
- Naltrexone methobromide
- MRZ 2663BR
- N-Methylnaltrexone bromide
- Naltrexone methyl bromide
- Methylnaltrexone bromide
- N-Cyclopropylmethyl-noroxymorphone methobromide
- Relistor
- MNTX
