[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-4-pyrazolecarboxylic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] 5-chloro-1-[(2-chlorophenyl)methyl]-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(2-chlorobenzyl)-3-methyl-pyrazole-4-carboxylic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C23H18Cl2N4O3 MolecularWeight: 469.32002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)Cl)CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)Cl)CC4=CC=CC=C4Cl

InChI

InChI=1S/C23H18Cl2N4O3/c1-14-21(22(25)29(28-14)12-15-6-2-3-8-17(15)24)23(31)32-13-20(30)27-19-10-4-9-18-16(19)7-5-11-26-18/h2-11H,12-13H2,1H3,(H,27,30)