2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-(p-tolylmethyl)-1,2,4-triazol-3-yl]acetamide CAS Name: 2-(3-methoxy-4-nitro-1-pyrazolyl)-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide IUPAC Name: 2-(3-methoxy-4-nitropyrazol-1-yl)-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-(4-methylbenzyl)-1,2,4-triazol-3-yl]acetamide Formula: C16H17N7O4 MolecularWeight: 371.35068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N7O4/c1-11-3-5-12(6-4-11)7-22-10-17-16(20-22)18-14(24)9-21-8-13(23(25)26)15(19-21)27-2/h3-6,8,10H,7,9H2,1-2H3,(H,18,20,24)