1-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[3-(2-amino-2-oxo-ethyl)sulfanylpropanoyl]indoline-2-carboxylic acid CAS Name: 1-[3-[(2-amino-2-oxoethyl)thio]-1-oxopropyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[3-(2-amino-2-oxoethyl)sulfanylpropanoyl]-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[3-[(2-amino-2-keto-ethyl)thio]propanoyl]indoline-2-carboxylic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C21)C(=O)CCSCC(=O)N)C(=O)O

Isomeric SMILES

C1C(N(C2=CC=CC=C21)C(=O)CCSCC(=O)N)C(=O)O

InChI

InChI=1S/C14H16N2O4S/c15-12(17)8-21-6-5-13(18)16-10-4-2-1-3-9(10)7-11(16)14(19)20/h1-4,11H,5-8H2,(H2,15,17)(H,19,20)