4-[3,3-dimethyl-5-(3-methylphenyl)-6-oxidanylidene-2H-pyran-4-yl]benzenesulfonamide

Systemtic Name: 4-[3,3-dimethyl-5-(3-methylphenyl)-6-oxidanylidene-2H-pyran-4-yl]benzenesulfonamide Openeye Name: 4-[3,3-dimethyl-5-(m-tolyl)-6-oxo-2H-pyran-4-yl]benzenesulfonamide CAS Name: 4-[3,3-dimethyl-5-(3-methylphenyl)-6-oxo-2H-pyran-4-yl]benzenesulfonamide IUPAC Name: 4-[3,3-dimethyl-5-(3-methylphenyl)-6-oxo-2H-pyran-4-yl]benzenesulfonamide Traditional Name: 4-[6-keto-3,3-dimethyl-5-(m-tolyl)-2H-pyran-4-yl]benzenesulfonamide Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C(COC2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C(COC2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H21NO4S/c1-13-5-4-6-15(11-13)17-18(20(2,3)12-25-19(17)22)14-7-9-16(10-8-14)26(21,23)24/h4-11H,12H2,1-3H3,(H2,21,23,24)