[2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl] 3-(methylsulfinylmethyl)benzoate

Systemtic Name: [2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl] 3-(methylsulfinylmethyl)benzoate Openeye Name: [2-(1-methylpyrrol-2-yl)-2-oxo-ethyl] 3-(methylsulfinylmethyl)benzoate CAS Name: 3-(methylsulfinylmethyl)benzoic acid [2-(1-methyl-2-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-methylpyrrol-2-yl)-2-oxoethyl] 3-(methylsulfinylmethyl)benzoate Traditional Name: 3-(methylsulfinylmethyl)benzoic acid [2-keto-2-(1-methylpyrrol-2-yl)ethyl] ester Formula: C16H17NO4S MolecularWeight: 319.37548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)COC(=O)C2=CC(=CC=C2)CS(=O)C

Isomeric SMILES

CN1C=CC=C1C(=O)COC(=O)C2=CC(=CC=C2)CS(=O)C

InChI

InChI=1S/C16H17NO4S/c1-17-8-4-7-14(17)15(18)10-21-16(19)13-6-3-5-12(9-13)11-22(2)20/h3-9H,10-11H2,1-2H3