4-[(E)-2-(6-methoxy-2-methyl-3H-inden-1-yl)-3-methylsulfonyl-prop-1-enyl]benzenesulfonamide

Systemtic Name: 4-[(E)-2-(6-methoxy-2-methyl-3H-inden-1-yl)-3-methylsulfonyl-prop-1-enyl]benzenesulfonamide Openeye Name: 4-[(E)-2-(6-methoxy-2-methyl-3H-inden-1-yl)-3-methylsulfonyl-prop-1-enyl]benzenesulfonamide CAS Name: 4-[(E)-2-(6-methoxy-2-methyl-3H-inden-1-yl)-3-methylsulfonylprop-1-enyl]benzenesulfonamide IUPAC Name: 4-[(E)-2-(6-methoxy-2-methyl-3H-inden-1-yl)-3-methylsulfonylprop-1-enyl]benzenesulfonamide Traditional Name: 4-[(E)-3-mesyl-2-(6-methoxy-2-methyl-3H-inden-1-yl)prop-1-enyl]benzenesulfonamide Formula: C21H23NO5S2 MolecularWeight: 433.54102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1)C=CC(=C2)OC)C(=CC3=CC=C(C=C3)S(=O)(=O)N)CS(=O)(=O)C

Isomeric SMILES

CC1=C(C2=C(C1)C=CC(=C2)OC)/C(=C\C3=CC=C(C=C3)S(=O)(=O)N)/CS(=O)(=O)C

InChI

InChI=1S/C21H23NO5S2/c1-14-10-16-6-7-18(27-2)12-20(16)21(14)17(13-28(3,23)24)11-15-4-8-19(9-5-15)29(22,25)26/h4-9,11-12H,10,13H2,1-3H3,(H2,22,25,26)/b17-11-