dioctyl 5-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfinamoyloxybenzene-1,3-dicarboxylate

Systemtic Name: dioctyl 5-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfinamoyloxybenzene-1,3-dicarboxylate Openeye Name: dioctyl 5-(3,5-dichloro-4-hydroxy-phenyl)sulfinamoyloxybenzene-1,3-dicarboxylate CAS Name: 5-(3,5-dichloro-4-hydroxyphenyl)sulfinamoyloxybenzene-1,3-dicarboxylic acid dioctyl ester IUPAC Name: dioctyl 5-(3,5-dichloro-4-hydroxyphenyl)sulfinamoyloxybenzene-1,3-dicarboxylate Traditional Name: 5-(3,5-dichloro-4-hydroxy-phenyl)sulfinamoyloxybenzene-1,3-dicarboxylic acid dioctyl ester Formula: C30H41Cl2NO7S MolecularWeight: 630.62004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC(=CC(=C1)OS(=O)NC2=CC(=C(C(=C2)Cl)O)Cl)C(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC(=CC(=C1)OS(=O)NC2=CC(=C(C(=C2)Cl)O)Cl)C(=O)OCCCCCCCC

InChI

InChI=1S/C30H41Cl2NO7S/c1-3-5-7-9-11-13-15-38-29(35)22-17-23(30(36)39-16-14-12-10-8-6-4-2)19-25(18-22)40-41(37)33-24-20-26(31)28(34)27(32)21-24/h17-21,33-34H,3-16H2,1-2H3