[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [1-[(3-chlorophenyl)methyl]-4-piperidin-1-iumyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-(3-chlorobenzyl)piperidin-1-ium-4-yl]-(4-phenylpiperazino)methanone Formula: C23H29ClN3O+ MolecularWeight: 398.94886

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCN(CC2)C3=CC=CC=C3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CCN(CC2)C3=CC=CC=C3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H28ClN3O/c24-21-6-4-5-19(17-21)18-25-11-9-20(10-12-25)23(28)27-15-13-26(14-16-27)22-7-2-1-3-8-22/h1-8,17,20H,9-16,18H2/p+1