1-[2-(3,4-dichlorophenyl)-2,4-bis(phenylmethyl)-4-piperazin-1-yl-piperidin-1-yl]ethanone

Systemtic Name: 1-[2-(3,4-dichlorophenyl)-2,4-bis(phenylmethyl)-4-piperazin-1-yl-piperidin-1-yl]ethanone Openeye Name: 1-[2,4-dibenzyl-2-(3,4-dichlorophenyl)-4-piperazin-1-yl-1-piperidyl]ethanone CAS Name: 1-[2-(3,4-dichlorophenyl)-2,4-bis(phenylmethyl)-4-(1-piperazinyl)-1-piperidinyl]ethanone IUPAC Name: 1-[2,4-dibenzyl-2-(3,4-dichlorophenyl)-4-piperazin-1-ylpiperidin-1-yl]ethanone Traditional Name: 1-[2,4-dibenzyl-2-(3,4-dichlorophenyl)-4-piperazino-piperidino]ethanone Formula: C31H35Cl2N3O MolecularWeight: 536.5351

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1(CC2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl)(CC4=CC=CC=C4)N5CCNCC5

Isomeric SMILES

CC(=O)N1CCC(CC1(CC2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl)(CC4=CC=CC=C4)N5CCNCC5

InChI

InChI=1S/C31H35Cl2N3O/c1-24(37)36-17-14-30(35-18-15-34-16-19-35,21-25-8-4-2-5-9-25)23-31(36,22-26-10-6-3-7-11-26)27-12-13-28(32)29(33)20-27/h2-13,20,34H,14-19,21-23H2,1H3