1-(2,4-dimethyl-1-pentyl-pyrrol-3-yl)octadecan-1-one

Systemtic Name: 1-(2,4-dimethyl-1-pentyl-pyrrol-3-yl)octadecan-1-one Openeye Name: 1-(2,4-dimethyl-1-pentyl-pyrrol-3-yl)octadecan-1-one CAS Name: 1-(2,4-dimethyl-1-pentyl-3-pyrrolyl)-1-octadecanone IUPAC Name: 1-(2,4-dimethyl-1-pentylpyrrol-3-yl)octadecan-1-one Traditional Name: 1-(1-amyl-2,4-dimethyl-pyrrol-3-yl)octadecan-1-one Formula: C29H53NO MolecularWeight: 431.73722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C=C1C)CCCCC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C=C1C)CCCCC)C

InChI

InChI=1S/C29H53NO/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-23-28(31)29-26(3)25-30(27(29)4)24-22-8-6-2/h25H,5-24H2,1-4H3