dimethyl 5-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzene-1,3-dicarboxylate CAS Name: 5-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H14N2O7 MolecularWeight: 358.30226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC=C2C=C(C=CC2=O)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC=C2C=C(C=CC2=O)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H14N2O7/c1-25-16(21)10-5-11(17(22)26-2)7-13(6-10)18-9-12-8-14(19(23)24)3-4-15(12)20/h3-9,18H,1-2H3