(2S)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-(indane-5-carbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2,3-dihydro-1H-inden-5-yl(oxo)methyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-(2,3-dihydro-1H-indene-5-carbonylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(indane-5-carbonylamino)-4-(methylthio)butyrate Formula: C15H18NO3S- MolecularWeight: 292.37332

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)C1=CC2=C(CCC2)C=C1

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)C1=CC2=C(CCC2)C=C1

InChI

InChI=1S/C15H19NO3S/c1-20-8-7-13(15(18)19)16-14(17)12-6-5-10-3-2-4-11(10)9-12/h5-6,9,13H,2-4,7-8H2,1H3,(H,16,17)(H,18,19)/p-1/t13-/m0/s1