[(2,6-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzoate

Systemtic Name: [(2,6-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzoate Openeye Name: [(2,6-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [(2,6-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(2,6-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [(4-keto-2,6-dimethyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C15H12N2O5 MolecularWeight: 300.26618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C=C(C1=NOC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=O)C=C(C1=NOC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H12N2O5/c1-9-6-13(18)7-10(2)14(9)16-22-15(19)11-4-3-5-12(8-11)17(20)21/h3-8H,1-2H3