dimethyl 5-[3-[2-(2-methoxy-2-oxidanylidene-ethyl)sulfanylethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-[2-(2-methoxy-2-oxidanylidene-ethyl)sulfanylethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-[2-(2-methoxy-2-oxo-ethyl)sulfanylacetyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate CAS Name: 5-[3-[2-[(2-methoxy-2-oxoethyl)thio]-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-[2-(2-methoxy-2-oxoethyl)sulfanylacetyl]-2,5-dimethylpyrrol-1-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[3-[2-[(2-keto-2-methoxy-ethyl)thio]acetyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H23NO7S MolecularWeight: 433.47482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C(=O)CSCC(=O)OC

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C(=O)CSCC(=O)OC

InChI

InChI=1S/C21H23NO7S/c1-12-6-17(18(23)10-30-11-19(24)27-3)13(2)22(12)16-8-14(20(25)28-4)7-15(9-16)21(26)29-5/h6-9H,10-11H2,1-5H3