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1-(3-ethanoylsulfanylpropanoyl)-5,6-dimethoxy-2,3-dihydroindole-2-carboxylic acid

1-(3-ethanoylsulfanylpropanoyl)-5,6-dimethoxy-2,3-dihydroindole-2-carboxylic acid

Systemtic Name:1-(3-ethanoylsulfanylpropanoyl)-5,6-dimethoxy-2,3-dihydroindole-2-carboxylic acid
Openeye Name:1-(3-acetylsulfanylpropanoyl)-5,6-dimethoxy-indoline-2-carboxylic acid
CAS Name:1-[3-(acetylthio)-1-oxopropyl]-5,6-dimethoxy-2,3-dihydroindole-2-carboxylic acid
IUPAC Name:1-(3-acetylsulfanylpropanoyl)-5,6-dimethoxy-2,3-dihydroindole-2-carboxylic acid
Traditional Name:1-[3-(acetylthio)propanoyl]-5,6-dimethoxy-indoline-2-carboxylic acid
Formula: C16H19NO6S
MolecularWeight: 353.39016
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(=O)N1C(CC2=CC(=C(C=C21)OC)OC)C(=O)O


Isomeric SMILES

CC(=O)SCCC(=O)N1C(CC2=CC(=C(C=C21)OC)OC)C(=O)O


InChI

InChI=1S/C16H19NO6S/c1-9(18)24-5-4-15(19)17-11-8-14(23-3)13(22-2)7-10(11)6-12(17)16(20)21/h7-8,12H,4-6H2,1-3H3,(H,20,21)


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