(E)-1-(2,5-dimethoxyphenyl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(2,5-dimethoxyphenyl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(2,5-dimethoxyphenyl)-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(2,5-dimethoxyphenyl)-3-(4-hydroxy-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(2,5-dimethoxyphenyl)-3-(4-hydroxy-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(2,5-dimethoxyphenyl)-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C=CC2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)/C=C/C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO6/c1-23-12-5-8-17(24-2)13(10-12)15(19)6-3-11-4-7-16(20)14(9-11)18(21)22/h3-10,20H,1-2H3/b6-3+