ethyl 2-(4-aminophenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 2-(4-aminophenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate Openeye Name: ethyl 2-(4-aminophenyl)-5-oxo-1H-pyrazole-4-carboxylate CAS Name: 2-(4-aminophenyl)-5-oxo-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-aminophenyl)-5-oxo-1H-pyrazole-4-carboxylate Traditional Name: 1-(4-aminophenyl)-3-keto-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(NC1=O)C2=CC=C(C=C2)N

Isomeric SMILES

CCOC(=O)C1=CN(NC1=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C12H13N3O3/c1-2-18-12(17)10-7-15(14-11(10)16)9-5-3-8(13)4-6-9/h3-7H,2,13H2,1H3,(H,14,16)