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

Systemtic Name: (E)-3-(4-dimethylaminophenyl)-1-[3-nitro-4,5-bis(oxidanyl)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(3,4-dihydroxy-5-nitro-phenyl)-3-(4-dimethylaminophenyl)prop-2-en-1-one CAS Name: (E)-1-(3,4-dihydroxy-5-nitrophenyl)-3-(4-dimethylaminophenyl)-2-propen-1-one IUPAC Name: (E)-1-(3,4-dihydroxy-5-nitrophenyl)-3-(4-dimethylaminophenyl)prop-2-en-1-one Traditional Name: (E)-1-(3,4-dihydroxy-5-nitro-phenyl)-3-(4-dimethylaminophenyl)prop-2-en-1-one Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5/c1-18(2)13-6-3-11(4-7-13)5-8-15(20)12-9-14(19(23)24)17(22)16(21)10-12/h3-10,21-22H,1-2H3/b8-5+