N-[(2-methylphenyl)methyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide

Systemtic Name: N-[(2-methylphenyl)methyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Openeye Name: 1-(4-nitrophenyl)-N-(o-tolylmethyl)pyrazole-4-carboxamide CAS Name: N-[(2-methylphenyl)methyl]-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: N-[(2-methylphenyl)methyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: N-(2-methylbenzyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O3/c1-13-4-2-3-5-14(13)10-19-18(23)15-11-20-21(12-15)16-6-8-17(9-7-16)22(24)25/h2-9,11-12H,10H2,1H3,(H,19,23)