N-(2-nitro-4-pyridin-4-yl-phenyl)hexanamide

Systemtic Name: N-(2-nitro-4-pyridin-4-yl-phenyl)hexanamide Openeye Name: N-[2-nitro-4-(4-pyridyl)phenyl]hexanamide CAS Name: N-(2-nitro-4-pyridin-4-ylphenyl)hexanamide IUPAC Name: N-(2-nitro-4-pyridin-4-ylphenyl)hexanamide Traditional Name: N-[2-nitro-4-(4-pyridyl)phenyl]hexanamide Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=C(C=C(C=C1)C2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCC(=O)NC1=C(C=C(C=C1)C2=CC=NC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3/c1-2-3-4-5-17(21)19-15-7-6-14(12-16(15)20(22)23)13-8-10-18-11-9-13/h6-12H,2-5H2,1H3,(H,19,21)