ethyl 4-[4-[(Z)-(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl]benzoate

Systemtic Name: ethyl 4-[4-[(Z)-(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl]benzoate Openeye Name: ethyl 4-[4-[(Z)-(5-methoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]benzoate CAS Name: 4-[4-[(Z)-(5-methoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(Z)-(5-methoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]benzoate Traditional Name: 4-[5-keto-4-[(Z)-(6-keto-5-methoxy-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]-3-phenyl-3-pyrazolin-1-yl]benzoic acid ethyl ester Formula: C26H21N3O7 MolecularWeight: 487.46084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=C(N2)C3=CC=CC=C3)C=C4C=C(C=C(C4=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=C(N2)C3=CC=CC=C3)/C=C\4/C=C(C=C(C4=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C26H21N3O7/c1-3-36-26(32)17-9-11-19(12-10-17)28-25(31)21(23(27-28)16-7-5-4-6-8-16)14-18-13-20(29(33)34)15-22(35-2)24(18)30/h4-15,27H,3H2,1-2H3/b18-14-