2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide Formula: C24H33ClN4O+2 MolecularWeight: 428.99802

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H31ClN4O/c25-21-7-4-8-23(17-21)29-15-13-28(14-16-29)19-24(30)26-22-9-11-27(12-10-22)18-20-5-2-1-3-6-20/h1-8,17,22H,9-16,18-19H2,(H,26,30)/p+2