2-[(1S,2S)-2-[2-(phenylsulfonyl)ethyl]-2,3-dihydro-1H-inden-1-yl]ethanenitrile

Systemtic Name: 2-[(1S,2S)-2-[2-(phenylsulfonyl)ethyl]-2,3-dihydro-1H-inden-1-yl]ethanenitrile Openeye Name: 2-[(1S,2S)-2-[2-(benzenesulfonyl)ethyl]indan-1-yl]acetonitrile CAS Name: 2-[(1S,2S)-2-[2-(benzenesulfonyl)ethyl]-2,3-dihydro-1H-inden-1-yl]acetonitrile IUPAC Name: 2-[(1S,2S)-2-[2-(benzenesulfonyl)ethyl]-2,3-dihydro-1H-inden-1-yl]acetonitrile Traditional Name: 2-[(1S,2S)-2-(2-besylethyl)indan-1-yl]acetonitrile Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=CC=CC=C21)CC#N)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1[C@H]([C@@H](C2=CC=CC=C21)CC#N)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO2S/c20-12-10-19-16(14-15-6-4-5-9-18(15)19)11-13-23(21,22)17-7-2-1-3-8-17/h1-9,16,19H,10-11,13-14H2/t16-,19+/m1/s1