2-methylpropyl 3-[(3-nitrophenyl)carbamoyl]pyrazole-1-carboxylate

Systemtic Name: 2-methylpropyl 3-[(3-nitrophenyl)carbamoyl]pyrazole-1-carboxylate Openeye Name: isobutyl 3-[(3-nitrophenyl)carbamoyl]pyrazole-1-carboxylate CAS Name: 3-[(3-nitroanilino)-oxomethyl]-1-pyrazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-[(3-nitrophenyl)carbamoyl]pyrazole-1-carboxylate Traditional Name: 3-[(3-nitrophenyl)carbamoyl]pyrazole-1-carboxylic acid isobutyl ester Formula: C15H16N4O5 MolecularWeight: 332.31134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1C=CC(=N1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC(=O)N1C=CC(=N1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O5/c1-10(2)9-24-15(21)18-7-6-13(17-18)14(20)16-11-4-3-5-12(8-11)19(22)23/h3-8,10H,9H2,1-2H3,(H,16,20)