2-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-ethyl-phenolate

Systemtic Name: 2-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-ethyl-phenolate Openeye Name: 2-[(3-bromo-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-ethyl-phenolate CAS Name: 2-[(3-bromo-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-ethylphenolate IUPAC Name: 2-[(3-bromo-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4-ethylphenolate Traditional Name: 2-[(3-bromo-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-ethyl-phenolate Formula: C15H12BrN2O4- MolecularWeight: 364.17078

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)[O-])NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)[O-])NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Br

InChI

InChI=1S/C15H13BrN2O4/c1-2-9-3-4-14(19)12(5-9)17-8-10-6-11(16)7-13(15(10)20)18(21)22/h3-8,17,19H,2H2,1H3/p-1