N-[(4-methylphenyl)methyl]-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-nitrophenyl)-N-(p-tolylmethyl)-1H-pyrazole-4-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide Traditional Name: N-(4-methylbenzyl)-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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