[(Z)-3-(4-nitrophenyl)carbonyl-4-oxidanylidene-pent-2-en-2-yl] 4-nitrobenzoate

Systemtic Name: [(Z)-3-(4-nitrophenyl)carbonyl-4-oxidanylidene-pent-2-en-2-yl] 4-nitrobenzoate Openeye Name: [(Z)-1-methyl-2-(4-nitrobenzoyl)-3-oxo-but-1-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(Z)-3-[(4-nitrophenyl)-oxomethyl]-4-oxopent-2-en-2-yl] ester IUPAC Name: [(Z)-3-(4-nitrobenzoyl)-4-oxopent-2-en-2-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(Z)-3-keto-1-methyl-2-(4-nitrobenzoyl)but-1-enyl] ester Formula: C19H14N2O8 MolecularWeight: 398.32306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14N2O8/c1-11(22)17(18(23)13-3-7-15(8-4-13)20(25)26)12(2)29-19(24)14-5-9-16(10-6-14)21(27)28/h3-10H,1-2H3/b17-12-