ethyl 4-[[(E)-(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-(5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate CAS Name: 4-[[(E)-(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-(5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate Traditional Name: 4-[[(E)-(6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoic acid ethyl ester Formula: C16H14N2O5 MolecularWeight: 314.29276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC=C2C=CC=C(C2=O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N/C=C/2\C=CC=C(C2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O5/c1-2-23-16(20)11-6-8-13(9-7-11)17-10-12-4-3-5-14(15(12)19)18(21)22/h3-10,17H,2H2,1H3/b12-10+