(E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-decoxy-3,5-dimethoxyphenyl)-1-[4-(4-nitrophenyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-decoxy-3,5-dimethoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-1-[4-(4-nitrophenyl)piperazino]prop-2-en-1-one Formula: C31H43N3O6 MolecularWeight: 553.68962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1OC)C=CC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1OC)/C=C/C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C31H43N3O6/c1-4-5-6-7-8-9-10-11-22-40-31-28(38-2)23-25(24-29(31)39-3)12-17-30(35)33-20-18-32(19-21-33)26-13-15-27(16-14-26)34(36)37/h12-17,23-24H,4-11,18-22H2,1-3H3/b17-12+