4-bromanyl-5-heptyl-5-oxidanyl-1-(phenylmethyl)pyrrol-2-one

Systemtic Name: 4-bromanyl-5-heptyl-5-oxidanyl-1-(phenylmethyl)pyrrol-2-one Openeye Name: 1-benzyl-4-bromo-5-heptyl-5-hydroxy-pyrrol-2-one CAS Name: 4-bromo-5-heptyl-5-hydroxy-1-(phenylmethyl)-2-pyrrolone IUPAC Name: 1-benzyl-4-bromo-5-heptyl-5-hydroxypyrrol-2-one Traditional Name: 1-benzyl-4-bromo-5-heptyl-5-hydroxy-3-pyrrolin-2-one Formula: C18H24BrNO2 MolecularWeight: 366.29266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(C(=CC(=O)N1CC2=CC=CC=C2)Br)O

Isomeric SMILES

CCCCCCCC1(C(=CC(=O)N1CC2=CC=CC=C2)Br)O

InChI

InChI=1S/C18H24BrNO2/c1-2-3-4-5-9-12-18(22)16(19)13-17(21)20(18)14-15-10-7-6-8-11-15/h6-8,10-11,13,22H,2-5,9,12,14H2,1H3