cyclooctyl-[(3R,5S)-5-[2-(2-fluorophenyl)ethylcarbamoyl]-1-propan-2-yl-pyrrolidin-3-yl]azanium

Systemtic Name: cyclooctyl-[(3R,5S)-5-[2-(2-fluorophenyl)ethylcarbamoyl]-1-propan-2-yl-pyrrolidin-3-yl]azanium Openeye Name: cyclooctyl-[(3R,5S)-5-[2-(2-fluorophenyl)ethylcarbamoyl]-1-isopropyl-pyrrolidin-3-yl]ammonium CAS Name: cyclooctyl-[(3R,5S)-5-[[2-(2-fluorophenyl)ethylamino]-oxomethyl]-1-propan-2-yl-3-pyrrolidinyl]ammonium IUPAC Name: cyclooctyl-[(3R,5S)-5-[2-(2-fluorophenyl)ethylcarbamoyl]-1-propan-2-ylpyrrolidin-3-yl]azanium Traditional Name: cyclooctyl-[(3R,5S)-5-[2-(2-fluorophenyl)ethylcarbamoyl]-1-isopropyl-pyrrolidin-3-yl]ammonium Formula: C24H39FN3O+ MolecularWeight: 404.584363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1C(=O)NCCC2=CC=CC=C2F)[NH2+]C3CCCCCCC3

Isomeric SMILES

CC(C)N1C[C@@H](C[C@H]1C(=O)NCCC2=CC=CC=C2F)[NH2+]C3CCCCCCC3

InChI

InChI=1S/C24H38FN3O/c1-18(2)28-17-21(27-20-11-6-4-3-5-7-12-20)16-23(28)24(29)26-15-14-19-10-8-9-13-22(19)25/h8-10,13,18,20-21,23,27H,3-7,11-12,14-17H2,1-2H3,(H,26,29)/p+1/t21-,23+/m1/s1