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

Systemtic Name: 1,5-dimethyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 1,5-dimethyl-4-nitro-N-[1-(o-tolylmethyl)pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 1,5-dimethyl-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1,5-dimethyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-nitropyrazole-3-carboxamide Traditional Name: 1,5-dimethyl-N-[1-(2-methylbenzyl)pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N6O3/c1-11-6-4-5-7-13(11)9-22-10-14(8-18-22)19-17(24)15-16(23(25)26)12(2)21(3)20-15/h4-8,10H,9H2,1-3H3,(H,19,24)