N-[(1S,3R)-1-(3,4-dimethoxyphenyl)-3-oxidanyl-5-oxidanylidene-9-phenylmethoxy-nonyl]-4-methyl-benzenesulfinamide

Systemtic Name: N-[(1S,3R)-1-(3,4-dimethoxyphenyl)-3-oxidanyl-5-oxidanylidene-9-phenylmethoxy-nonyl]-4-methyl-benzenesulfinamide Openeye Name: N-[(1S,3R)-9-benzyloxy-1-(3,4-dimethoxyphenyl)-3-hydroxy-5-oxo-nonyl]-4-methyl-benzenesulfinamide CAS Name: N-[(1S,3R)-1-(3,4-dimethoxyphenyl)-3-hydroxy-5-oxo-9-phenylmethoxynonyl]-4-methylbenzenesulfinamide IUPAC Name: N-[(1S,3R)-1-(3,4-dimethoxyphenyl)-3-hydroxy-5-oxo-9-phenylmethoxynonyl]-4-methylbenzenesulfinamide Traditional Name: N-[(1S,3R)-9-benzoxy-1-(3,4-dimethoxyphenyl)-3-hydroxy-5-keto-nonyl]-4-methyl-benzenesulfinamide Formula: C31H39NO6S MolecularWeight: 553.70946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(CC(CC(=O)CCCCOCC2=CC=CC=C2)O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)[S@@](=O)N[C@@H](C[C@H](CC(=O)CCCCOCC2=CC=CC=C2)O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C31H39NO6S/c1-23-12-15-28(16-13-23)39(35)32-29(25-14-17-30(36-2)31(19-25)37-3)21-27(34)20-26(33)11-7-8-18-38-22-24-9-5-4-6-10-24/h4-6,9-10,12-17,19,27,29,32,34H,7-8,11,18,20-22H2,1-3H3/t27-,29-,39+/m0/s1