1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3-(3,4-dimethoxyphenyl)-1-propanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-3-(3,4-dimethoxyphenyl)propan-1-one Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C22H27ClN2O3/c1-27-20-9-5-17(15-21(20)28-2)6-10-22(26)25-13-11-24(12-14-25)16-18-3-7-19(23)8-4-18/h3-5,7-9,15H,6,10-14,16H2,1-2H3