(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methanesulfonic acid

Systemtic Name: (S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methanesulfonic acid Openeye Name: (S)-4-quinolyl-(5-vinylquinuclidin-2-yl)methanesulfonic acid CAS Name: (S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(4-quinolinyl)methanesulfonic acid IUPAC Name: (S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanesulfonic acid Traditional Name: (S)-4-quinolyl-(5-vinylquinuclidin-2-yl)methanesulfonic acid Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)S(=O)(=O)O

Isomeric SMILES

C=CC1CN2CCC1CC2[C@H](C3=CC=NC4=CC=CC=C34)S(=O)(=O)O

InChI

InChI=1S/C19H22N2O3S/c1-2-13-12-21-10-8-14(13)11-18(21)19(25(22,23)24)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19H,1,8,10-12H2,(H,22,23,24)/t13?,14?,18?,19-/m0/s1