1-methyl-4-nitro-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 1-methyl-4-nitro-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: 1-methyl-4-nitro-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-benzyl-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O3/c1-15-8-10(16(18)19)11(14-15)12(17)13-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,17)