4-octanoyl-5-oxidanyl-1,2-dihydropyrrol-3-one

Systemtic Name: 4-octanoyl-5-oxidanyl-1,2-dihydropyrrol-3-one Openeye Name: 5-hydroxy-4-octanoyl-1,2-dihydropyrrol-3-one CAS Name: 5-hydroxy-4-(1-oxooctyl)-1,2-dihydropyrrol-3-one IUPAC Name: 5-hydroxy-4-octanoyl-1,2-dihydropyrrol-3-one Traditional Name: 4-caprylyl-5-hydroxy-2-pyrrolin-3-one Formula: C12H19NO3 MolecularWeight: 225.28416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C(NCC1=O)O

Isomeric SMILES

CCCCCCCC(=O)C1=C(NCC1=O)O

InChI

InChI=1S/C12H19NO3/c1-2-3-4-5-6-7-9(14)11-10(15)8-13-12(11)16/h13,16H,2-8H2,1H3