N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]pentanamide

Systemtic Name: N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]pentanamide Openeye Name: N-[3-nitro-4-(2-pyridylmethyl)phenyl]pentanamide CAS Name: N-[3-nitro-4-(2-pyridinylmethyl)phenyl]pentanamide IUPAC Name: N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]pentanamide Traditional Name: N-[3-nitro-4-(2-pyridylmethyl)phenyl]valeramide Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=C(C=C1)CC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=CC(=C(C=C1)CC2=CC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3/c1-2-3-7-17(21)19-15-9-8-13(16(12-15)20(22)23)11-14-6-4-5-10-18-14/h4-6,8-10,12H,2-3,7,11H2,1H3,(H,19,21)