4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-methoxypyridin-3-yl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-methoxypyridin-3-yl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-methoxy-3-pyridyl)benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(6-methoxy-3-pyridinyl)benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(6-methoxypyridin-3-yl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-methoxy-3-pyridyl)benzamide Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CN=C(C=C3)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CN=C(C=C3)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4/c1-12-18(24(26)27)13(2)23(22-12)11-14-4-6-15(7-5-14)19(25)21-16-8-9-17(28-3)20-10-16/h4-10H,11H2,1-3H3,(H,21,25)