ethyl 5-(2-aminophenyl)carbonyl-2-butanoyl-3,4-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl 5-(2-aminophenyl)carbonyl-2-butanoyl-3,4-dihydropyrazole-3-carboxylate Openeye Name: ethyl 5-(2-aminobenzoyl)-2-butanoyl-3,4-dihydropyrazole-3-carboxylate CAS Name: 5-[(2-aminophenyl)-oxomethyl]-2-(1-oxobutyl)-3,4-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-aminobenzoyl)-2-butanoyl-3,4-dihydropyrazole-3-carboxylate Traditional Name: 5-anthraniloyl-2-butyryl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(CC(=N1)C(=O)C2=CC=CC=C2N)C(=O)OCC

Isomeric SMILES

CCCC(=O)N1C(CC(=N1)C(=O)C2=CC=CC=C2N)C(=O)OCC

InChI

InChI=1S/C17H21N3O4/c1-3-7-15(21)20-14(17(23)24-4-2)10-13(19-20)16(22)11-8-5-6-9-12(11)18/h5-6,8-9,14H,3-4,7,10,18H2,1-2H3