4-nitro-N-(10-oxidanyloctadecan-9-yl)benzamide

Systemtic Name: 4-nitro-N-(10-oxidanyloctadecan-9-yl)benzamide Openeye Name: N-(2-hydroxy-1-octyl-decyl)-4-nitro-benzamide CAS Name: N-(10-hydroxyoctadecan-9-yl)-4-nitrobenzamide IUPAC Name: N-(10-hydroxyoctadecan-9-yl)-4-nitrobenzamide Traditional Name: N-(2-hydroxy-1-octyl-decyl)-4-nitro-benzamide Formula: C25H42N2O4 MolecularWeight: 434.61198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCCCCCCC)O)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCC(C(CCCCCCCC)O)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C25H42N2O4/c1-3-5-7-9-11-13-15-23(24(28)16-14-12-10-8-6-4-2)26-25(29)21-17-19-22(20-18-21)27(30)31/h17-20,23-24,28H,3-16H2,1-2H3,(H,26,29)