[2-methoxy-4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [2-methoxy-4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Openeye Name: [2-methoxy-4-[(E)-[(4-nitrophenyl)hydrazono]methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-methoxy-4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-methoxy-4-[(E)-[(4-nitrophenyl)hydrazono]methyl]phenyl] ester Formula: C21H16N4O7 MolecularWeight: 436.37434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O7/c1-31-20-11-14(13-22-23-16-6-8-17(9-7-16)24(27)28)5-10-19(20)32-21(26)15-3-2-4-18(12-15)25(29)30/h2-13,23H,1H3/b22-13+