1-[3-(phenylcarbonylsulfanyl)propanoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[3-(phenylcarbonylsulfanyl)propanoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-(3-benzoylsulfanylpropanoyl)indoline-2-carboxylic acid CAS Name: 1-[3-(benzoylthio)-1-oxopropyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-(3-benzoylsulfanylpropanoyl)-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[3-(benzoylthio)propanoyl]indoline-2-carboxylic acid Formula: C19H17NO4S MolecularWeight: 355.40758

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C21)C(=O)CCSC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(N(C2=CC=CC=C21)C(=O)CCSC(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H17NO4S/c21-17(10-11-25-19(24)13-6-2-1-3-7-13)20-15-9-5-4-8-14(15)12-16(20)18(22)23/h1-9,16H,10-12H2,(H,22,23)