7-[4-chloranyl-1-[4-(1-oxidanylheptyl)phenyl]-5-oxidanylidene-pyrrolidin-2-yl]heptanoic acid

Systemtic Name: 7-[4-chloranyl-1-[4-(1-oxidanylheptyl)phenyl]-5-oxidanylidene-pyrrolidin-2-yl]heptanoic acid Openeye Name: 7-[4-chloro-1-[4-(1-hydroxyheptyl)phenyl]-5-oxo-pyrrolidin-2-yl]heptanoic acid CAS Name: 7-[4-chloro-1-[4-(1-hydroxyheptyl)phenyl]-5-oxo-2-pyrrolidinyl]heptanoic acid IUPAC Name: 7-[4-chloro-1-[4-(1-hydroxyheptyl)phenyl]-5-oxopyrrolidin-2-yl]heptanoic acid Traditional Name: 7-[4-chloro-1-[4-(1-hydroxyheptyl)phenyl]-5-keto-pyrrolidin-2-yl]enanthic acid Formula: C24H36ClNO4 MolecularWeight: 437.99994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=C(C=C1)N2C(CC(C2=O)Cl)CCCCCCC(=O)O)O

Isomeric SMILES

CCCCCCC(C1=CC=C(C=C1)N2C(CC(C2=O)Cl)CCCCCCC(=O)O)O

InChI

InChI=1S/C24H36ClNO4/c1-2-3-4-8-11-22(27)18-13-15-19(16-14-18)26-20(17-21(25)24(26)30)10-7-5-6-9-12-23(28)29/h13-16,20-22,27H,2-12,17H2,1H3,(H,28,29)