(phenylmethyl) N-[2-(4-nitrophenyl)-3-oxidanylidene-1H-pyrazol-4-yl]carbamate

Systemtic Name: (phenylmethyl) N-[2-(4-nitrophenyl)-3-oxidanylidene-1H-pyrazol-4-yl]carbamate Openeye Name: benzyl N-[2-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]carbamate CAS Name: N-[2-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]carbamate Traditional Name: N-[5-keto-1-(4-nitrophenyl)-3-pyrazolin-4-yl]carbamic acid benzyl ester Formula: C17H14N4O5 MolecularWeight: 354.31686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CNN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CNN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O5/c22-16-15(19-17(23)26-11-12-4-2-1-3-5-12)10-18-20(16)13-6-8-14(9-7-13)21(24)25/h1-10,18H,11H2,(H,19,23)