N-[(2S)-butan-2-yl]-3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propane-1-sulfonamide

Systemtic Name: N-[(2S)-butan-2-yl]-3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propane-1-sulfonamide Openeye Name: 3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-N-[(1S)-1-methylpropyl]propane-1-sulfonamide CAS Name: N-[(2S)-butan-2-yl]-3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-propanesulfonamide IUPAC Name: N-[(2S)-butan-2-yl]-3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propane-1-sulfonamide Traditional Name: 3-(2,2-dimethylcoumaran-7-yl)oxy-N-[(1S)-1-methylpropyl]propane-1-sulfonamide Formula: C17H27NO4S MolecularWeight: 341.46558

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)CCCOC1=CC=CC2=C1OC(C2)(C)C

Isomeric SMILES

CC[C@H](C)NS(=O)(=O)CCCOC1=CC=CC2=C1OC(C2)(C)C

InChI

InChI=1S/C17H27NO4S/c1-5-13(2)18-23(19,20)11-7-10-21-15-9-6-8-14-12-17(3,4)22-16(14)15/h6,8-9,13,18H,5,7,10-12H2,1-4H3/t13-/m0/s1