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

Systemtic Name: [2-(4-nitrophenyl)-5-propan-2-yl-pyrazol-3-yl] benzoate Openeye Name: [5-isopropyl-2-(4-nitrophenyl)pyrazol-3-yl] benzoate CAS Name: benzoic acid [2-(4-nitrophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(4-nitrophenyl)-5-propan-2-ylpyrazol-3-yl] benzoate Traditional Name: benzoic acid [5-isopropyl-2-(4-nitrophenyl)pyrazol-3-yl] ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O4/c1-13(2)17-12-18(26-19(23)14-6-4-3-5-7-14)21(20-17)15-8-10-16(11-9-15)22(24)25/h3-13H,1-2H3