(3S)-3-(4-chlorophenyl)-1-oxidanylidene-N-(4-sulfamoylphenyl)-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-3-(4-chlorophenyl)-1-oxidanylidene-N-(4-sulfamoylphenyl)-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-3-(4-chlorophenyl)-1-oxo-N-(4-sulfamoylphenyl)isochromane-6-carboxamide CAS Name: (3S)-3-(4-chlorophenyl)-1-oxo-N-(4-sulfamoylphenyl)-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-3-(4-chlorophenyl)-1-oxo-N-(4-sulfamoylphenyl)-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-3-(4-chlorophenyl)-1-keto-N-(4-sulfamoylphenyl)isochroman-6-carboxamide Formula: C22H17ClN2O5S MolecularWeight: 456.89878

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1[C@H](OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN2O5S/c23-16-4-1-13(2-5-16)20-12-15-11-14(3-10-19(15)22(27)30-20)21(26)25-17-6-8-18(9-7-17)31(24,28)29/h1-11,20H,12H2,(H,25,26)(H2,24,28,29)/t20-/m0/s1