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

Systemtic Name: (E)-3-(4-dimethylaminophenyl)-1-(5-nitro-2-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-dimethylaminophenyl)-1-(2-hydroxy-5-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-(4-dimethylaminophenyl)-1-(2-hydroxy-5-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-dimethylaminophenyl)-1-(2-hydroxy-5-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-dimethylaminophenyl)-1-(2-hydroxy-5-nitro-phenyl)prop-2-en-1-one Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O4/c1-18(2)13-6-3-12(4-7-13)5-9-16(20)15-11-14(19(22)23)8-10-17(15)21/h3-11,21H,1-2H3/b9-5+