methyl 5-(4-chlorophenyl)-2-[(4-ethoxycarbonylphenyl)carbamoyl]-3,4-dihydropyrazole-4-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-2-[(4-ethoxycarbonylphenyl)carbamoyl]-3,4-dihydropyrazole-4-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-2-[(4-ethoxycarbonylphenyl)carbamoyl]-3,4-dihydropyrazole-4-carboxylate CAS Name: 5-(4-chlorophenyl)-2-[(4-ethoxycarbonylanilino)-oxomethyl]-3,4-dihydropyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-2-[(4-ethoxycarbonylphenyl)carbamoyl]-3,4-dihydropyrazole-4-carboxylate Traditional Name: 1-[(4-carbethoxyphenyl)carbamoyl]-3-(4-chlorophenyl)-2-pyrazoline-4-carboxylic acid methyl ester Formula: C21H20ClN3O5 MolecularWeight: 429.8536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O5/c1-3-30-19(26)14-6-10-16(11-7-14)23-21(28)25-12-17(20(27)29-2)18(24-25)13-4-8-15(22)9-5-13/h4-11,17H,3,12H2,1-2H3,(H,23,28)