1-(3-ethoxy-4-oxidanyl-phenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(3-ethoxy-4-oxidanyl-phenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butane-1,4-dione Openeye Name: 1-[4-[(E)-cinnamyl]piperazin-1-yl]-4-(3-ethoxy-4-hydroxy-phenyl)butane-1,4-dione CAS Name: 1-(3-ethoxy-4-hydroxyphenyl)-4-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(3-ethoxy-4-hydroxyphenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butane-1,4-dione Traditional Name: 1-[4-[(E)-cinnamyl]piperazino]-4-(3-ethoxy-4-hydroxy-phenyl)butane-1,4-dione Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)CCC(=O)N2CCN(CC2)CC=CC3=CC=CC=C3)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)CCC(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3)O

InChI

InChI=1S/C25H30N2O4/c1-2-31-24-19-21(10-11-23(24)29)22(28)12-13-25(30)27-17-15-26(16-18-27)14-6-9-20-7-4-3-5-8-20/h3-11,19,29H,2,12-18H2,1H3/b9-6+