[5-ethyl-3-fluoranyl-1-methyl-5-(2-phenethylphenoxy)pyrrolidin-3-yl] dodecanoate

Systemtic Name: [5-ethyl-3-fluoranyl-1-methyl-5-(2-phenethylphenoxy)pyrrolidin-3-yl] dodecanoate Openeye Name: [5-ethyl-3-fluoro-1-methyl-5-(2-phenethylphenoxy)pyrrolidin-3-yl] dodecanoate CAS Name: dodecanoic acid [5-ethyl-3-fluoro-1-methyl-5-(2-phenethylphenoxy)-3-pyrrolidinyl] ester IUPAC Name: [5-ethyl-3-fluoro-1-methyl-5-(2-phenethylphenoxy)pyrrolidin-3-yl] dodecanoate Traditional Name: lauric acid [5-ethyl-3-fluoro-1-methyl-5-(2-phenethylphenoxy)pyrrolidin-3-yl] ester Formula: C33H48FNO3 MolecularWeight: 525.737523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1(CC(N(C1)C)(CC)OC2=CC=CC=C2CCC3=CC=CC=C3)F

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1(CC(N(C1)C)(CC)OC2=CC=CC=C2CCC3=CC=CC=C3)F

InChI

InChI=1S/C33H48FNO3/c1-4-6-7-8-9-10-11-12-16-23-31(36)38-32(34)26-33(5-2,35(3)27-32)37-30-22-18-17-21-29(30)25-24-28-19-14-13-15-20-28/h13-15,17-22H,4-12,16,23-27H2,1-3H3