ethyl 5-azanyl-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-azanyl-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-amino-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-amino-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-phenylpyrazole-3-carboxylate Traditional Name: 5-amino-1-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)N)C2=CC=CC=C2

InChI

InChI=1S/C12H13N3O2/c1-2-17-12(16)10-8-11(13)15(14-10)9-6-4-3-5-7-9/h3-8H,2,13H2,1H3