methyl (6E)-6-(5-azanyl-7-bromanyl-8-oxidanylidene-quinolin-2-ylidene)-1H-pyridine-2-carboxylate

Systemtic Name: methyl (6E)-6-(5-azanyl-7-bromanyl-8-oxidanylidene-quinolin-2-ylidene)-1H-pyridine-2-carboxylate Openeye Name: methyl (6E)-6-(5-amino-7-bromo-8-oxo-2-quinolylidene)-1H-pyridine-2-carboxylate CAS Name: (6E)-6-(5-amino-7-bromo-8-oxo-2-quinolinylidene)-1H-pyridine-2-carboxylic acid methyl ester IUPAC Name: methyl (6E)-6-(5-amino-7-bromo-8-oxoquinolin-2-ylidene)-1H-pyridine-2-carboxylate Traditional Name: (6E)-6-(5-amino-7-bromo-8-keto-2-quinolylidene)-1H-pyridine-2-carboxylic acid methyl ester Formula: C16H12BrN3O3 MolecularWeight: 374.18878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C2C=CC3=C(C=C(C(=O)C3=N2)Br)N)N1

Isomeric SMILES

COC(=O)C1=CC=C/C(=C\2/C=CC3=C(C=C(C(=O)C3=N2)Br)N)/N1

InChI

InChI=1S/C16H12BrN3O3/c1-23-16(22)13-4-2-3-11(19-13)12-6-5-8-10(18)7-9(17)15(21)14(8)20-12/h2-7,19H,18H2,1H3/b12-11+