ethyl 4-azanyl-6-[(8-chloranyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]quinoline-3-carboxylate

Systemtic Name: ethyl 4-azanyl-6-[(8-chloranyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]quinoline-3-carboxylate Openeye Name: ethyl 4-amino-6-[(8-chloro-4-oxo-1H-quinoline-3-carbonyl)amino]quinoline-3-carboxylate CAS Name: 4-amino-6-[[(8-chloro-4-oxo-1H-quinolin-3-yl)-oxomethyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-[(8-chloro-4-oxo-1H-quinoline-3-carbonyl)amino]quinoline-3-carboxylate Traditional Name: 4-amino-6-[(8-chloro-4-keto-1H-quinoline-3-carbonyl)amino]quinoline-3-carboxylic acid ethyl ester Formula: C22H17ClN4O4 MolecularWeight: 436.84778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)C3=CNC4=C(C3=O)C=CC=C4Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)C3=CNC4=C(C3=O)C=CC=C4Cl

InChI

InChI=1S/C22H17ClN4O4/c1-2-31-22(30)14-9-25-17-7-6-11(8-13(17)18(14)24)27-21(29)15-10-26-19-12(20(15)28)4-3-5-16(19)23/h3-10H,2H2,1H3,(H2,24,25)(H,26,28)(H,27,29)