methyl 3-(6-methylsulfonylindol-1-yl)-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-(6-methylsulfonylindol-1-yl)-3-oxidanylidene-propanoate Openeye Name: methyl 3-(6-methylsulfonylindol-1-yl)-3-oxo-propanoate CAS Name: 3-(6-methylsulfonyl-1-indolyl)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(6-methylsulfonylindol-1-yl)-3-oxopropanoate Traditional Name: 3-keto-3-(6-mesylindol-1-yl)propionic acid methyl ester Formula: C13H13NO5S MolecularWeight: 295.31102

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)N1C=CC2=C1C=C(C=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)CC(=O)N1C=CC2=C1C=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C13H13NO5S/c1-19-13(16)8-12(15)14-6-5-9-3-4-10(7-11(9)14)20(2,17)18/h3-7H,8H2,1-2H3