(5E)-2-(2,4-dinitrophenyl)-5-(4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carbaldehyde

Systemtic Name: (5E)-2-(2,4-dinitrophenyl)-5-(4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carbaldehyde Openeye Name: (5E)-2-(2,4-dinitrophenyl)-5-(4-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carbaldehyde CAS Name: (5E)-2-(2,4-dinitrophenyl)-5-(4-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyrazole-4-carboxaldehyde IUPAC Name: (5E)-2-(2,4-dinitrophenyl)-5-(4-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carbaldehyde Traditional Name: (3E)-1-(2,4-dinitrophenyl)-3-(6-keto-4-methoxy-cyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-4-carbaldehyde Formula: C17H12N4O7 MolecularWeight: 384.29978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2C(=CN(N2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C=O)C=C1

Isomeric SMILES

COC1=CC(=O)/C(=C/2\C(=CN(N2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C=O)/C=C1

InChI

InChI=1S/C17H12N4O7/c1-28-12-3-4-13(16(23)7-12)17-10(9-22)8-19(18-17)14-5-2-11(20(24)25)6-15(14)21(26)27/h2-9,18H,1H3/b17-13+