1-(2-methyl-4-oxidanylidene-2-sulfanyl-pentanoyl)-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-(2-methyl-4-oxidanylidene-2-sulfanyl-pentanoyl)-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-(2-methyl-4-oxo-2-sulfanyl-pentanoyl)indoline-2-carboxylic acid CAS Name: 1-(2-mercapto-2-methyl-1,4-dioxopentyl)-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-(2-methyl-4-oxo-2-sulfanylpentanoyl)-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-(4-keto-2-mercapto-2-methyl-pentanoyl)indoline-2-carboxylic acid Formula: C15H17NO4S MolecularWeight: 307.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C(=O)N1C(CC2=CC=CC=C21)C(=O)O)S

Isomeric SMILES

CC(=O)CC(C)(C(=O)N1C(CC2=CC=CC=C21)C(=O)O)S

InChI

InChI=1S/C15H17NO4S/c1-9(17)8-15(2,21)14(20)16-11-6-4-3-5-10(11)7-12(16)13(18)19/h3-6,12,21H,7-8H2,1-2H3,(H,18,19)