ethyl 4-[[(Z)-(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate

Systemtic Name: ethyl 4-[[(Z)-(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate Openeye Name: ethyl 4-[[(Z)-(3-bromo-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate CAS Name: 4-[[(Z)-(3-bromo-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(Z)-(3-bromo-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate Traditional Name: 4-[[(Z)-(3-bromo-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoic acid ethyl ester Formula: C16H13BrN2O5 MolecularWeight: 393.18882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrN2O5/c1-2-24-16(21)10-3-5-13(6-4-10)18-9-11-7-12(17)8-14(15(11)20)19(22)23/h3-9,18H,2H2,1H3/b11-9-