N-(2-methylpropyl)-N-[3-[oxidanyl-(phenylmethyl)amino]propyl]-2,3-dihydro-1-benzofuran-5-sulfonamide

Systemtic Name: N-(2-methylpropyl)-N-[3-[oxidanyl-(phenylmethyl)amino]propyl]-2,3-dihydro-1-benzofuran-5-sulfonamide Openeye Name: N-[3-[benzyl(hydroxy)amino]propyl]-N-isobutyl-2,3-dihydrobenzofuran-5-sulfonamide CAS Name: N-[3-[hydroxy-(phenylmethyl)amino]propyl]-N-(2-methylpropyl)-2,3-dihydrobenzofuran-5-sulfonamide IUPAC Name: N-[3-[benzyl(hydroxy)amino]propyl]-N-(2-methylpropyl)-2,3-dihydro-1-benzofuran-5-sulfonamide Traditional Name: N-[3-[benzyl(hydroxy)amino]propyl]-N-isobutyl-coumaran-5-sulfonamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCCN(CC1=CC=CC=C1)O)S(=O)(=O)C2=CC3=C(C=C2)OCC3

Isomeric SMILES

CC(C)CN(CCCN(CC1=CC=CC=C1)O)S(=O)(=O)C2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C22H30N2O4S/c1-18(2)16-24(13-6-12-23(25)17-19-7-4-3-5-8-19)29(26,27)21-9-10-22-20(15-21)11-14-28-22/h3-5,7-10,15,18,25H,6,11-14,16-17H2,1-2H3