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3-(4-methoxy-1-methyl-indol-2-yl)sulfanylpropanoic acid

3-(4-methoxy-1-methyl-indol-2-yl)sulfanylpropanoic acid

Systemtic Name:3-(4-methoxy-1-methyl-indol-2-yl)sulfanylpropanoic acid
Openeye Name:3-(4-methoxy-1-methyl-indol-2-yl)sulfanylpropanoic acid
CAS Name:3-[(4-methoxy-1-methyl-2-indolyl)thio]propanoic acid
IUPAC Name:3-(4-methoxy-1-methylindol-2-yl)sulfanylpropanoic acid
Traditional Name:3-[(4-methoxy-1-methyl-indol-2-yl)thio]propionic acid
Formula: C13H15NO3S
MolecularWeight: 265.3281
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C1SCCC(=O)O)C(=CC=C2)OC


Isomeric SMILES

CN1C2=C(C=C1SCCC(=O)O)C(=CC=C2)OC


InChI

InChI=1S/C13H15NO3S/c1-14-10-4-3-5-11(17-2)9(10)8-12(14)18-7-6-13(15)16/h3-5,8H,6-7H2,1-2H3,(H,15,16)


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