ethyl 5-(2-azanyl-5-chloranyl-phenyl)carbonyl-2-(phenylcarbonyl)-3,4-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl 5-(2-azanyl-5-chloranyl-phenyl)carbonyl-2-(phenylcarbonyl)-3,4-dihydropyrazole-3-carboxylate Openeye Name: ethyl 5-(2-amino-5-chloro-benzoyl)-2-benzoyl-3,4-dihydropyrazole-3-carboxylate CAS Name: 5-[(2-amino-5-chlorophenyl)-oxomethyl]-2-benzoyl-3,4-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-5-chlorobenzoyl)-2-benzoyl-3,4-dihydropyrazole-3-carboxylate Traditional Name: 5-(2-amino-5-chloro-benzoyl)-2-benzoyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=NN1C(=O)C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Cl)N

Isomeric SMILES

CCOC(=O)C1CC(=NN1C(=O)C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Cl)N

InChI

InChI=1S/C20H18ClN3O4/c1-2-28-20(27)17-11-16(18(25)14-10-13(21)8-9-15(14)22)23-24(17)19(26)12-6-4-3-5-7-12/h3-10,17H,2,11,22H2,1H3