3-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(2-methylindolin-1-yl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-keto-2-(2-methylindolin-1-yl)ethyl]thio]propionic acid Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSCCC(=O)O

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CSCCC(=O)O

InChI

InChI=1S/C14H17NO3S/c1-10-8-11-4-2-3-5-12(11)15(10)13(16)9-19-7-6-14(17)18/h2-5,10H,6-9H2,1H3,(H,17,18)