1-(2,4-dimethyl-1H-pyrrol-3-yl)hexadecan-1-one

Systemtic Name: 1-(2,4-dimethyl-1H-pyrrol-3-yl)hexadecan-1-one Openeye Name: 1-(2,4-dimethyl-1H-pyrrol-3-yl)hexadecan-1-one CAS Name: 1-(2,4-dimethyl-1H-pyrrol-3-yl)-1-hexadecanone IUPAC Name: 1-(2,4-dimethyl-1H-pyrrol-3-yl)hexadecan-1-one Traditional Name: 1-(2,4-dimethyl-1H-pyrrol-3-yl)hexadecan-1-one Formula: C22H39NO MolecularWeight: 333.55116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C1=C(NC=C1C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C1=C(NC=C1C)C

InChI

InChI=1S/C22H39NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)22-19(2)18-23-20(22)3/h18,23H,4-17H2,1-3H3