methyl 2-(4-chlorophenyl)-2-[4-(4-dimethylaminophenyl)carbonylpiperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(4-chlorophenyl)-2-[4-(4-dimethylaminophenyl)carbonylpiperazin-1-yl]ethanoate Openeye Name: methyl 2-(4-chlorophenyl)-2-[4-[4-(dimethylamino)benzoyl]piperazin-1-yl]acetate CAS Name: 2-(4-chlorophenyl)-2-[4-[(4-dimethylaminophenyl)-oxomethyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)-2-[4-[4-(dimethylamino)benzoyl]piperazin-1-yl]acetate Traditional Name: 2-(4-chlorophenyl)-2-[4-[4-(dimethylamino)benzoyl]piperazino]acetic acid methyl ester Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C22H26ClN3O3/c1-24(2)19-10-6-17(7-11-19)21(27)26-14-12-25(13-15-26)20(22(28)29-3)16-4-8-18(23)9-5-16/h4-11,20H,12-15H2,1-3H3