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

Systemtic Name: [2-(4-nitrophenyl)-5-propan-2-yl-pyrazol-3-yl] heptanoate Openeye Name: [5-isopropyl-2-(4-nitrophenyl)pyrazol-3-yl] heptanoate CAS Name: heptanoic acid [2-(4-nitrophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(4-nitrophenyl)-5-propan-2-ylpyrazol-3-yl] heptanoate Traditional Name: enanthic acid [5-isopropyl-2-(4-nitrophenyl)pyrazol-3-yl] ester Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCCCCCC(=O)OC1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C19H25N3O4/c1-4-5-6-7-8-19(23)26-18-13-17(14(2)3)20-21(18)15-9-11-16(12-10-15)22(24)25/h9-14H,4-8H2,1-3H3