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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=C1C=CC(=C2)CCC(=O)C(=O)O)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1C(CC2=C1C=CC(=C2)CCC(=O)C(=O)O)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H21NO5S/c22-19(20(23)24)9-7-14-6-8-16-11-18(12-17(16)10-14)21-27(25,26)13-15-4-2-1-3-5-15/h1-6,8,10,18,21H,7,9,11-13H2,(H,23,24)