(4-methylphenyl) 3-(dodecoxymethylcarbamoyl)-4-oxidanyl-benzenesulfinate

Systemtic Name: (4-methylphenyl) 3-(dodecoxymethylcarbamoyl)-4-oxidanyl-benzenesulfinate Openeye Name: p-tolyl 3-(dodecoxymethylcarbamoyl)-4-hydroxy-benzenesulfinate CAS Name: 3-[(dodecoxymethylamino)-oxomethyl]-4-hydroxybenzenesulfinic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 3-(dodecoxymethylcarbamoyl)-4-hydroxybenzenesulfinate Traditional Name: 4-hydroxy-3-(lauryloxymethylcarbamoyl)benzenesulfinic acid p-tolyl ester Formula: C27H39NO5S MolecularWeight: 489.66726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCNC(=O)C1=C(C=CC(=C1)S(=O)OC2=CC=C(C=C2)C)O

Isomeric SMILES

CCCCCCCCCCCCOCNC(=O)C1=C(C=CC(=C1)S(=O)OC2=CC=C(C=C2)C)O

InChI

InChI=1S/C27H39NO5S/c1-3-4-5-6-7-8-9-10-11-12-19-32-21-28-27(30)25-20-24(17-18-26(25)29)34(31)33-23-15-13-22(2)14-16-23/h13-18,20,29H,3-12,19,21H2,1-2H3,(H,28,30)