2-[2-(2-methylsulfinylphenyl)pyrrol-1-yl]ethanal

Systemtic Name: 2-[2-(2-methylsulfinylphenyl)pyrrol-1-yl]ethanal Openeye Name: 2-[2-(2-methylsulfinylphenyl)pyrrol-1-yl]acetaldehyde CAS Name: 2-[2-(2-methylsulfinylphenyl)-1-pyrrolyl]acetaldehyde IUPAC Name: 2-[2-(2-methylsulfinylphenyl)pyrrol-1-yl]acetaldehyde Traditional Name: 2-[2-(2-methylsulfinylphenyl)pyrrol-1-yl]acetaldehyde Formula: C13H13NO2S MolecularWeight: 247.31282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC=CC=C1C2=CC=CN2CC=O

Isomeric SMILES

CS(=O)C1=CC=CC=C1C2=CC=CN2CC=O

InChI

InChI=1S/C13H13NO2S/c1-17(16)13-7-3-2-5-11(13)12-6-4-8-14(12)9-10-15/h2-8,10H,9H2,1H3