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

Systemtic Name: ethyl 5-(2-azanyl-5-chloranyl-phenyl)carbonyl-2-cyclobutylcarbonyl-3,4-dihydropyrazole-3-carboxylate Openeye Name: ethyl 5-(2-amino-5-chloro-benzoyl)-2-(cyclobutanecarbonyl)-3,4-dihydropyrazole-3-carboxylate CAS Name: 5-[(2-amino-5-chlorophenyl)-oxomethyl]-2-[cyclobutyl(oxo)methyl]-3,4-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-5-chlorobenzoyl)-2-(cyclobutanecarbonyl)-3,4-dihydropyrazole-3-carboxylate Traditional Name: 5-(2-amino-5-chloro-benzoyl)-2-(cyclobutanecarbonyl)-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C18H20ClN3O4 MolecularWeight: 377.8221

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=NN1C(=O)C2CCC2)C(=O)C3=C(C=CC(=C3)Cl)N

Isomeric SMILES

CCOC(=O)C1CC(=NN1C(=O)C2CCC2)C(=O)C3=C(C=CC(=C3)Cl)N

InChI

InChI=1S/C18H20ClN3O4/c1-2-26-18(25)15-9-14(21-22(15)17(24)10-4-3-5-10)16(23)12-8-11(19)6-7-13(12)20/h6-8,10,15H,2-5,9,20H2,1H3