1-[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium CAS Name: 1-[1-[(3-chlorophenyl)methyl]-4-piperidin-1-iumyl]-4-(2-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[1-(3-chlorobenzyl)piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Formula: C23H32ClN3O+2 MolecularWeight: 401.97268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H30ClN3O/c1-28-23-8-3-2-7-22(23)27-15-13-26(14-16-27)21-9-11-25(12-10-21)18-19-5-4-6-20(24)17-19/h2-8,17,21H,9-16,18H2,1H3/p+2