methyl 4-(3-chlorophenyl)-2-[(4-methoxycarbonylphenyl)carbamoyl]-3H-pyrazole-4-carboxylate

Systemtic Name: methyl 4-(3-chlorophenyl)-2-[(4-methoxycarbonylphenyl)carbamoyl]-3H-pyrazole-4-carboxylate Openeye Name: methyl 4-(3-chlorophenyl)-2-[(4-methoxycarbonylphenyl)carbamoyl]-3H-pyrazole-4-carboxylate CAS Name: 4-(3-chlorophenyl)-2-[(4-methoxycarbonylanilino)-oxomethyl]-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-chlorophenyl)-2-[(4-methoxycarbonylphenyl)carbamoyl]-3H-pyrazole-4-carboxylate Traditional Name: 1-[(4-carbomethoxyphenyl)carbamoyl]-4-(3-chlorophenyl)-2-pyrazoline-4-carboxylic acid methyl ester Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)N2CC(C=N2)(C3=CC(=CC=C3)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)N2CC(C=N2)(C3=CC(=CC=C3)Cl)C(=O)OC

InChI

InChI=1S/C20H18ClN3O5/c1-28-17(25)13-6-8-16(9-7-13)23-19(27)24-12-20(11-22-24,18(26)29-2)14-4-3-5-15(21)10-14/h3-11H,12H2,1-2H3,(H,23,27)