(E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-phenylcyclopropyl)carbonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-phenylcyclopropyl)carbonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[oxo-(2-phenylcyclopropyl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-phenylcyclopropanecarbonyl)piperazino]prop-2-en-1-one Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CC=C4)OC

InChI

InChI=1S/C25H28N2O4/c1-30-22-10-8-18(16-23(22)31-2)9-11-24(28)26-12-14-27(15-13-26)25(29)21-17-20(21)19-6-4-3-5-7-19/h3-11,16,20-21H,12-15,17H2,1-2H3/b11-9+