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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-])[O-])C

InChI

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