N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 3-nitro-N-[1-(o-tolylmethyl)pyrazol-4-yl]-1H-pyrazole-5-carboxamide CAS Name: N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[1-(2-methylbenzyl)pyrazol-4-yl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C15H14N6O3 MolecularWeight: 326.31006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O3/c1-10-4-2-3-5-11(10)8-20-9-12(7-16-20)17-15(22)13-6-14(19-18-13)21(23)24/h2-7,9H,8H2,1H3,(H,17,22)(H,18,19)