3-(3-chloranyl-4-methyl-phenyl)-1-(4-methyl-2-phenyl-piperazin-1-yl)propan-1-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-(4-methyl-2-phenyl-piperazin-1-yl)propan-1-one Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-(4-methyl-2-phenyl-piperazin-1-yl)propan-1-one CAS Name: 3-(3-chloro-4-methylphenyl)-1-(4-methyl-2-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-(4-methyl-2-phenyl-piperazino)propan-1-one Formula: C21H25ClN2O MolecularWeight: 356.889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2C3=CC=CC=C3)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2C3=CC=CC=C3)C)Cl

InChI

InChI=1S/C21H25ClN2O/c1-16-8-9-17(14-19(16)22)10-11-21(25)24-13-12-23(2)15-20(24)18-6-4-3-5-7-18/h3-9,14,20H,10-13,15H2,1-2H3