1-[(2-methylphenyl)methyl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-[(2-methylphenyl)methyl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 4-nitro-1-(o-tolylmethyl)pyrazole-3-carboxamide CAS Name: 1-[(2-methylphenyl)methyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-[(2-methylphenyl)methyl]-4-nitropyrazole-3-carboxamide Traditional Name: 1-(2-methylbenzyl)-4-nitro-pyrazole-3-carboxamide Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C(=N2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C(=N2)C(=O)N)[N+](=O)[O-]

InChI

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