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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)C3=NN(C(=C3[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)C3=NN(C(=C3[N+](=O)[O-])C)C

InChI

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