methyl 4-[[5-nitro-2-(phenylmethyl)pyrazol-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[5-nitro-2-(phenylmethyl)pyrazol-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[(2-benzyl-5-nitro-pyrazole-3-carbonyl)amino]benzoate CAS Name: 4-[[[5-nitro-2-(phenylmethyl)-3-pyrazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-benzyl-5-nitropyrazole-3-carbonyl)amino]benzoate Traditional Name: 4-[(2-benzyl-5-nitro-pyrazole-3-carbonyl)amino]benzoic acid methyl ester Formula: C19H16N4O5 MolecularWeight: 380.35414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NN2CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NN2CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5/c1-28-19(25)14-7-9-15(10-8-14)20-18(24)16-11-17(23(26)27)21-22(16)12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,20,24)