N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]propanamide Traditional Name: 3-besyl-N-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]propionamide Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO5S/c1-3-26-19-12-16-11-15(2)27-20(16)13-17(19)14-22-21(23)9-10-28(24,25)18-7-5-4-6-8-18/h4-8,12-13,15H,3,9-11,14H2,1-2H3,(H,22,23)/t15-/m0/s1