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

Systemtic Name: [2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate Openeye Name: [2-(4-carbamoylanilino)-2-oxo-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-(4-carbamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-carbamoylanilino)-2-oxoethyl] 5-chloro-1-[(2-chlorophenyl)methyl]-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(2-chlorobenzyl)-3-methyl-pyrazole-4-carboxylic acid [2-(4-carbamoylanilino)-2-keto-ethyl] ester Formula: C21H18Cl2N4O4 MolecularWeight: 461.29802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)N)Cl)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)N)Cl)CC3=CC=CC=C3Cl

InChI

InChI=1S/C21H18Cl2N4O4/c1-12-18(19(23)27(26-12)10-14-4-2-3-5-16(14)22)21(30)31-11-17(28)25-15-8-6-13(7-9-15)20(24)29/h2-9H,10-11H2,1H3,(H2,24,29)(H,25,28)