(E)-3-(4-tert-butylphenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-tert-butylphenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-tert-butylphenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-tert-butylphenyl)-1-[4-(3-chlorophenyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-tert-butylphenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-tert-butylphenyl)-1-[4-(3-chlorophenyl)piperazino]prop-2-en-1-one Formula: C23H27ClN2O MolecularWeight: 382.92628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H27ClN2O/c1-23(2,3)19-10-7-18(8-11-19)9-12-22(27)26-15-13-25(14-16-26)21-6-4-5-20(24)17-21/h4-12,17H,13-16H2,1-3H3/b12-9+