N,N-dimethyl-4-(1-methylpyrrolidin-1-ium-1-yl)-2,2-diphenyl-butanamide bromide

Systemtic Name: N,N-dimethyl-4-(1-methylpyrrolidin-1-ium-1-yl)-2,2-diphenyl-butanamide bromide Openeye Name: N,N-dimethyl-4-(1-methylpyrrolidin-1-ium-1-yl)-2,2-diphenyl-butanamide bromide CAS Name: N,N-dimethyl-4-(1-methyl-1-pyrrolidin-1-iumyl)-2,2-diphenylbutanamide bromide IUPAC Name: N,N-dimethyl-4-(1-methylpyrrolidin-1-ium-1-yl)-2,2-diphenylbutanamide bromide Traditional Name: N,N-dimethyl-4-(1-methylpyrrolidin-1-ium-1-yl)-2,2-diphenyl-butyramide bromide Formula: C23H31BrN2O MolecularWeight: 431.40904

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(CC[N+]1(CCCC1)C)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CN(C)C(=O)C(CC[N+]1(CCCC1)C)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C23H31N2O.BrH/c1-24(2)22(26)23(20-12-6-4-7-13-20,21-14-8-5-9-15-21)16-19-25(3)17-10-11-18-25;/h4-9,12-15H,10-11,16-19H2,1-3H3;1H/q+1;/p-1