N-[(E)-(6-methylpyridin-2-yl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(6-methylpyridin-2-yl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-[(E)-(6-methyl-2-pyridyl)methyleneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: N-[(E)-(6-methyl-2-pyridinyl)methylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-(6-methylpyridin-2-yl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: N-[(E)-(6-methyl-2-pyridyl)methyleneamino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C18H16N6O3 MolecularWeight: 364.35804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C=NNC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=N1)/C=N/NC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O3/c1-13-3-2-4-15(20-13)11-19-21-18(25)17-9-10-23(22-17)12-14-5-7-16(8-6-14)24(26)27/h2-11H,12H2,1H3,(H,21,25)/b19-11+