(2-azanyl-2-oxidanylidene-ethyl) 4-pyrazol-1-ylbenzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-pyrazol-1-ylbenzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid (2-amino-2-keto-ethyl) ester Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC(=O)N

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC(=O)N

InChI

InChI=1S/C12H11N3O3/c13-11(16)8-18-12(17)9-2-4-10(5-3-9)15-7-1-6-14-15/h1-7H,8H2,(H2,13,16)