[5-methyl-2-(4-nitrophenyl)pyrazol-3-yl] benzoate

Systemtic Name: [5-methyl-2-(4-nitrophenyl)pyrazol-3-yl] benzoate Openeye Name: [5-methyl-2-(4-nitrophenyl)pyrazol-3-yl] benzoate CAS Name: benzoic acid [5-methyl-2-(4-nitrophenyl)-3-pyrazolyl] ester IUPAC Name: [5-methyl-2-(4-nitrophenyl)pyrazol-3-yl] benzoate Traditional Name: benzoic acid [5-methyl-2-(4-nitrophenyl)pyrazol-3-yl] ester Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=C1)OC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4/c1-12-11-16(24-17(21)13-5-3-2-4-6-13)19(18-12)14-7-9-15(10-8-14)20(22)23/h2-11H,1H3