(3R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-1-keto-isochroman-3-carboxamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C2CC3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)[C@H]2CC3=CC=CC=C3C(=O)O2)C

InChI

InChI=1S/C21H24N2O5S/c1-4-23(5-2)29(26,27)19-13-16(11-10-14(19)3)22-20(24)18-12-15-8-6-7-9-17(15)21(25)28-18/h6-11,13,18H,4-5,12H2,1-3H3,(H,22,24)/t18-/m1/s1