2-nitro-3-[[3-(1-oxidanylhexyl)phenyl]methyl]benzamide

Systemtic Name: 2-nitro-3-[[3-(1-oxidanylhexyl)phenyl]methyl]benzamide Openeye Name: 3-[[3-(1-hydroxyhexyl)phenyl]methyl]-2-nitro-benzamide CAS Name: 3-[[3-(1-hydroxyhexyl)phenyl]methyl]-2-nitrobenzamide IUPAC Name: 3-[[3-(1-hydroxyhexyl)phenyl]methyl]-2-nitrobenzamide Traditional Name: 3-[3-(1-hydroxyhexyl)benzyl]-2-nitro-benzamide Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC(=C1)CC2=CC=CC(=C2[N+](=O)[O-])C(=O)N)O

Isomeric SMILES

CCCCCC(C1=CC=CC(=C1)CC2=CC=CC(=C2[N+](=O)[O-])C(=O)N)O

InChI

InChI=1S/C20H24N2O4/c1-2-3-4-11-18(23)15-8-5-7-14(12-15)13-16-9-6-10-17(20(21)24)19(16)22(25)26/h5-10,12,18,23H,2-4,11,13H2,1H3,(H2,21,24)