(3S)-N-(4-methoxy-2-methyl-phenyl)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidine-1-carboxamide

Systemtic Name: (3S)-N-(4-methoxy-2-methyl-phenyl)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidine-1-carboxamide Openeye Name: (3S)-N-(4-methoxy-2-methyl-phenyl)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidine-1-carboxamide CAS Name: (3S)-N-(4-methoxy-2-methylphenyl)-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-piperidinecarboxamide IUPAC Name: (3S)-N-(4-methoxy-2-methylphenyl)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidine-1-carboxamide Traditional Name: (3S)-N-(4-methoxy-2-methyl-phenyl)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidine-1-carboxamide Formula: C25H35N4O3+ MolecularWeight: 439.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=O)N2CCCC(C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=O)N2CCC[C@@H](C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H34N4O3/c1-19-17-21(31-2)10-11-22(19)26-25(30)29-12-6-7-20(18-29)27-13-15-28(16-14-27)23-8-4-5-9-24(23)32-3/h4-5,8-11,17,20H,6-7,12-16,18H2,1-3H3,(H,26,30)/p+1/t20-/m0/s1