[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) (2S)-2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: (2S)-2-(benzenesulfonamido)-3-methylbutanoic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] (2S)-2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: (2S)-2-(benzenesulfonamido)-3-methyl-butyric acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC2=C(CCC2)C=C1)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)C1=CC2=C(CCC2)C=C1)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO5S/c1-15(2)21(23-29(26,27)19-9-4-3-5-10-19)22(25)28-14-20(24)18-12-11-16-7-6-8-17(16)13-18/h3-5,9-13,15,21,23H,6-8,14H2,1-2H3/t21-/m0/s1