1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,3-dimethyl-2-(2-methylphenoxy)butan-1-one

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,3-dimethyl-2-(2-methylphenoxy)butan-1-one Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,3-dimethyl-2-(2-methylphenoxy)butan-1-one CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3,3-dimethyl-2-(2-methylphenoxy)-1-butanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,3-dimethyl-2-(2-methylphenoxy)butan-1-one Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-3,3-dimethyl-2-(2-methylphenoxy)butan-1-one Formula: C24H31ClN2O2 MolecularWeight: 414.96814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1OC(C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(C)(C)C

InChI

InChI=1S/C24H31ClN2O2/c1-18-7-5-6-8-21(18)29-22(24(2,3)4)23(28)27-15-13-26(14-16-27)17-19-9-11-20(25)12-10-19/h5-12,22H,13-17H2,1-4H3