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

Systemtic Name: (3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)piperidine-1-carboxamide Openeye Name: (3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(p-tolyl)piperidine-1-carboxamide CAS Name: (3S)-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-N-(4-methylphenyl)-1-piperidinecarboxamide IUPAC Name: (3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)piperidine-1-carboxamide Traditional Name: (3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(p-tolyl)piperidine-1-carboxamide Formula: C24H33N4O2+ MolecularWeight: 409.54442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N4O2/c1-19-9-11-20(12-10-19)25-24(29)28-13-5-6-21(18-28)26-14-16-27(17-15-26)22-7-3-4-8-23(22)30-2/h3-4,7-12,21H,5-6,13-18H2,1-2H3,(H,25,29)/p+1/t21-/m0/s1