N-[5-methyl-2-[(3-methylphenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[5-methyl-2-[(3-methylphenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-[5-methyl-2-(m-tolylmethyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[5-methyl-2-[(3-methylphenyl)methyl]-3-pyrazolyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[5-methyl-2-[(3-methylphenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-[5-methyl-2-(3-methylbenzyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC(=N2)C)NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC(=N2)C)NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O3/c1-12-4-3-5-14(6-12)9-22-16(7-13(2)20-22)19-17(24)11-21-10-15(8-18-21)23(25)26/h3-8,10H,9,11H2,1-2H3,(H,19,24)