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

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

CCCCC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H27ClN2O/c1-2-3-5-19-8-10-20(11-9-19)12-13-23(27)26-16-14-25(15-17-26)22-7-4-6-21(24)18-22/h4,6-13,18H,2-3,5,14-17H2,1H3/b13-12+