(3S)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3S)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3S)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O6S/c1-5-24(6-2)31(27,28)16-11-12-19(29-4)18(13-16)23-21(26)22(3)14-15-9-7-8-10-17(15)20(25)30-22/h7-13H,5-6,14H2,1-4H3,(H,23,26)/t22-/m0/s1