ethyl 6-(bromomethyl)-8-nitro-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-(bromomethyl)-8-nitro-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-(bromomethyl)-8-nitro-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-(bromomethyl)-8-nitro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(bromomethyl)-8-nitro-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-(bromomethyl)-4-keto-8-nitro-1H-quinoline-3-carboxylic acid ethyl ester Formula: C13H11BrN2O5 MolecularWeight: 355.14084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)CBr)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)CBr)[N+](=O)[O-]

InChI

InChI=1S/C13H11BrN2O5/c1-2-21-13(18)9-6-15-11-8(12(9)17)3-7(5-14)4-10(11)16(19)20/h3-4,6H,2,5H2,1H3,(H,15,17)