[2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 4-nitrobenzoate

Systemtic Name: [2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 4-nitrobenzoate Openeye Name: [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(2-chlorophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(2-chlorophenyl)-5-propan-2-ylpyrazol-3-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C19H16ClN3O4 MolecularWeight: 385.80104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)C1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

InChI

InChI=1S/C19H16ClN3O4/c1-12(2)16-11-18(22(21-16)17-6-4-3-5-15(17)20)27-19(24)13-7-9-14(10-8-13)23(25)26/h3-12H,1-2H3