[5-ethyl-5-[2-(4-fluoranyl-3-methoxy-phenyl)ethyl]-1-methyl-4-phenoxy-pyrrolidin-3-yl] dodecanoate

Systemtic Name: [5-ethyl-5-[2-(4-fluoranyl-3-methoxy-phenyl)ethyl]-1-methyl-4-phenoxy-pyrrolidin-3-yl] dodecanoate Openeye Name: [5-ethyl-5-[2-(4-fluoro-3-methoxy-phenyl)ethyl]-1-methyl-4-phenoxy-pyrrolidin-3-yl] dodecanoate CAS Name: dodecanoic acid [5-ethyl-5-[2-(4-fluoro-3-methoxyphenyl)ethyl]-1-methyl-4-phenoxy-3-pyrrolidinyl] ester IUPAC Name: [5-ethyl-5-[2-(4-fluoro-3-methoxyphenyl)ethyl]-1-methyl-4-phenoxypyrrolidin-3-yl] dodecanoate Traditional Name: lauric acid [5-ethyl-5-[2-(4-fluoro-3-methoxy-phenyl)ethyl]-1-methyl-4-phenoxy-pyrrolidin-3-yl] ester Formula: C34H50FNO4 MolecularWeight: 555.763503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1CN(C(C1OC2=CC=CC=C2)(CC)CCC3=CC(=C(C=C3)F)OC)C

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1CN(C(C1OC2=CC=CC=C2)(CC)CCC3=CC(=C(C=C3)F)OC)C

InChI

InChI=1S/C34H50FNO4/c1-5-7-8-9-10-11-12-13-17-20-32(37)40-31-26-36(3)34(6-2,33(31)39-28-18-15-14-16-19-28)24-23-27-21-22-29(35)30(25-27)38-4/h14-16,18-19,21-22,25,31,33H,5-13,17,20,23-24,26H2,1-4H3