methyl 4-(1-methylindol-3-yl)-2-methylsulfanyl-butanoate

Systemtic Name: methyl 4-(1-methylindol-3-yl)-2-methylsulfanyl-butanoate Openeye Name: methyl 4-(1-methylindol-3-yl)-2-methylsulfanyl-butanoate CAS Name: 4-(1-methyl-3-indolyl)-2-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 4-(1-methylindol-3-yl)-2-methylsulfanylbutanoate Traditional Name: 4-(1-methylindol-3-yl)-2-(methylthio)butyric acid methyl ester Formula: C15H19NO2S MolecularWeight: 277.38186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CCC(C(=O)OC)SC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CCC(C(=O)OC)SC

InChI

InChI=1S/C15H19NO2S/c1-16-10-11(12-6-4-5-7-13(12)16)8-9-14(19-3)15(17)18-2/h4-7,10,14H,8-9H2,1-3H3