ethyl 5-[[3,6-bis(chloranyl)-2-methoxy-phenyl]carbonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[3,6-bis(chloranyl)-2-methoxy-phenyl]carbonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(3,6-dichloro-2-methoxy-benzoyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[(3,6-dichloro-2-methoxyphenyl)-oxomethyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3,6-dichloro-2-methoxybenzoyl)amino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[(3,6-dichloro-2-methoxy-benzoyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C23H18Cl2N4O4 MolecularWeight: 485.31942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C4=C(C=CC(=C4OC)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C4=C(C=CC(=C4OC)Cl)Cl

InChI

InChI=1S/C23H18Cl2N4O4/c1-3-33-23(31)14-12-26-29(18-11-8-13-6-4-5-7-17(13)27-18)21(14)28-22(30)19-15(24)9-10-16(25)20(19)32-2/h4-12H,3H2,1-2H3,(H,28,30)