7-[2-(1-hydroxyethyl)-3-nitro-phenoxy]-N-(6-oxidanylhexyl)-N-phenyl-heptanamide

Systemtic Name: 7-[2-(1-hydroxyethyl)-3-nitro-phenoxy]-N-(6-oxidanylhexyl)-N-phenyl-heptanamide Openeye Name: 7-[2-(1-hydroxyethyl)-3-nitro-phenoxy]-N-(6-hydroxyhexyl)-N-phenyl-heptanamide CAS Name: 7-[2-(1-hydroxyethyl)-3-nitrophenoxy]-N-(6-hydroxyhexyl)-N-phenylheptanamide IUPAC Name: 7-[2-(1-hydroxyethyl)-3-nitrophenoxy]-N-(6-hydroxyhexyl)-N-phenylheptanamide Traditional Name: 7-[2-(1-hydroxyethyl)-3-nitro-phenoxy]-N-(6-hydroxyhexyl)-N-phenyl-enanthamide Formula: C27H38N2O6 MolecularWeight: 486.60042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC=C1OCCCCCCC(=O)N(CCCCCCO)C2=CC=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C1=C(C=CC=C1OCCCCCCC(=O)N(CCCCCCO)C2=CC=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C27H38N2O6/c1-22(31)27-24(29(33)34)16-13-17-25(27)35-21-12-5-2-9-18-26(32)28(19-10-3-4-11-20-30)23-14-7-6-8-15-23/h6-8,13-17,22,30-31H,2-5,9-12,18-21H2,1H3