(E)-3-(3-methoxy-4-propoxy-phenyl)-1-[4-(4-methylphenyl)carbonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-methoxy-4-propoxy-phenyl)-1-[4-(4-methylphenyl)carbonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3-methoxy-4-propoxy-phenyl)-1-[4-(4-methylbenzoyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3-methoxy-4-propoxyphenyl)-1-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-methoxy-4-propoxyphenyl)-1-[4-(4-methylbenzoyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3-methoxy-4-propoxy-phenyl)-1-(4-p-toluoylpiperazino)prop-2-en-1-one Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C)OC

InChI

InChI=1S/C25H30N2O4/c1-4-17-31-22-11-7-20(18-23(22)30-3)8-12-24(28)26-13-15-27(16-14-26)25(29)21-9-5-19(2)6-10-21/h5-12,18H,4,13-17H2,1-3H3/b12-8+