N-[(E)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(E)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-nitrophenyl)methyl]-N-[(E)-1-(p-tolyl)ethylideneamino]pyrazole-3-carboxamide CAS Name: N-[(E)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: 1-(4-nitrobenzyl)-N-[(E)-1-(p-tolyl)ethylideneamino]pyrazole-3-carboxamide Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NNC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N/NC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-])/C

InChI

InChI=1S/C20H19N5O3/c1-14-3-7-17(8-4-14)15(2)21-22-20(26)19-11-12-24(23-19)13-16-5-9-18(10-6-16)25(27)28/h3-12H,13H2,1-2H3,(H,22,26)/b21-15+