6-(azepan-1-yl)-N-(2-methyl-5-nitro-phenyl)pyridine-3-carboxamide

Systemtic Name: 6-(azepan-1-yl)-N-(2-methyl-5-nitro-phenyl)pyridine-3-carboxamide Openeye Name: 6-(azepan-1-yl)-N-(2-methyl-5-nitro-phenyl)pyridine-3-carboxamide CAS Name: 6-(1-azepanyl)-N-(2-methyl-5-nitrophenyl)-3-pyridinecarboxamide IUPAC Name: 6-(azepan-1-yl)-N-(2-methyl-5-nitrophenyl)pyridine-3-carboxamide Traditional Name: 6-(azepan-1-yl)-N-(2-methyl-5-nitro-phenyl)nicotinamide Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CN=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CN=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C19H22N4O3/c1-14-6-8-16(23(25)26)12-17(14)21-19(24)15-7-9-18(20-13-15)22-10-4-2-3-5-11-22/h6-9,12-13H,2-5,10-11H2,1H3,(H,21,24)