2-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]propanal

Systemtic Name: 2-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]propanal Openeye Name: 2-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)propanal CAS Name: 2-(3-benzoyl-2,5-dimethyl-1-pyrrolyl)propanal IUPAC Name: 2-(3-benzoyl-2,5-dimethylpyrrol-1-yl)propanal Traditional Name: 2-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)propionaldehyde Formula: C16H17NO2 MolecularWeight: 255.31168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C=O)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(N1C(C)C=O)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO2/c1-11-9-15(13(3)17(11)12(2)10-18)16(19)14-7-5-4-6-8-14/h4-10,12H,1-3H3