3-methyl-4-oxidanylidene-4-[1-(phenylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]butanoic acid

Systemtic Name: 3-methyl-4-oxidanylidene-4-[1-(phenylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]butanoic acid Openeye Name: 4-[1-(benzenesulfonamido)indan-5-yl]-3-methyl-4-oxo-butanoic acid CAS Name: 4-[1-(benzenesulfonamido)-2,3-dihydro-1H-inden-5-yl]-3-methyl-4-oxobutanoic acid IUPAC Name: 4-[1-(benzenesulfonamido)-2,3-dihydro-1H-inden-5-yl]-3-methyl-4-oxobutanoic acid Traditional Name: 4-[1-(benzenesulfonamido)indan-5-yl]-4-keto-3-methyl-butyric acid Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(=O)C1=CC2=C(C=C1)C(CC2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)O)C(=O)C1=CC2=C(C=C1)C(CC2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO5S/c1-13(11-19(22)23)20(24)15-7-9-17-14(12-15)8-10-18(17)21-27(25,26)16-5-3-2-4-6-16/h2-7,9,12-13,18,21H,8,10-11H2,1H3,(H,22,23)