methyl 3-(5-methylsulfanyl-3H-pyrrol-3-yl)-3-oxidanyl-2-phenyl-propanoate

Systemtic Name: methyl 3-(5-methylsulfanyl-3H-pyrrol-3-yl)-3-oxidanyl-2-phenyl-propanoate Openeye Name: methyl 3-hydroxy-3-(5-methylsulfanyl-3H-pyrrol-3-yl)-2-phenyl-propanoate CAS Name: 3-hydroxy-3-[5-(methylthio)-3H-pyrrol-3-yl]-2-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-3-(5-methylsulfanyl-3H-pyrrol-3-yl)-2-phenylpropanoate Traditional Name: 3-hydroxy-3-[5-(methylthio)-3H-pyrrol-3-yl]-2-phenyl-propionic acid methyl ester Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)C(C2C=C(N=C2)SC)O

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)C(C2C=C(N=C2)SC)O

InChI

InChI=1S/C15H17NO3S/c1-19-15(18)13(10-6-4-3-5-7-10)14(17)11-8-12(20-2)16-9-11/h3-9,11,13-14,17H,1-2H3