2,2-dimethyl-N-[[7-(4-methylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[[7-(4-methylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide Openeye Name: 2,2-dimethyl-N-[[7-(4-methylsulfonylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]propanamide CAS Name: 2,2-dimethyl-N-[[7-(4-methylsulfonylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]propanamide IUPAC Name: 2,2-dimethyl-N-[[7-(4-methylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide Traditional Name: N-[[7-(4-mesylphenyl)coumaran-2-yl]methyl]-2,2-dimethyl-propionamide Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCC1CC2=CC=CC(=C2O1)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C(=O)NCC1CC2=CC=CC(=C2O1)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H25NO4S/c1-21(2,3)20(23)22-13-16-12-15-6-5-7-18(19(15)26-16)14-8-10-17(11-9-14)27(4,24)25/h5-11,16H,12-13H2,1-4H3,(H,22,23)