tert-butyl 3-(butylamino)-5-(decoxymethylsulfamoyl)-4-phenoxy-benzoate

Systemtic Name: tert-butyl 3-(butylamino)-5-(decoxymethylsulfamoyl)-4-phenoxy-benzoate Openeye Name: tert-butyl 3-(butylamino)-5-(decoxymethylsulfamoyl)-4-phenoxy-benzoate CAS Name: 3-(butylamino)-5-(decoxymethylsulfamoyl)-4-phenoxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(butylamino)-5-(decoxymethylsulfamoyl)-4-phenoxybenzoate Traditional Name: 3-(butylamino)-5-(decoxymethylsulfamoyl)-4-phenoxy-benzoic acid tert-butyl ester Formula: C32H50N2O6S MolecularWeight: 590.8142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOCNS(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)NCCCC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCOCNS(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)NCCCC)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H50N2O6S/c1-6-8-10-11-12-13-14-18-22-38-25-34-41(36,37)29-24-26(31(35)40-32(3,4)5)23-28(33-21-9-7-2)30(29)39-27-19-16-15-17-20-27/h15-17,19-20,23-24,33-34H,6-14,18,21-22,25H2,1-5H3