(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methanol; terephthalic acid

Systemtic Name: (5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methanol; terephthalic acid Openeye Name: (5-ethylquinuclidin-2-yl)-(4-quinolyl)methanol; terephthalic acid CAS Name: (5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(4-quinolinyl)methanol; terephthalic acid IUPAC Name: (5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol; terephthalic acid Traditional Name: (5-ethylquinuclidin-2-yl)-(4-quinolyl)methanol; terephthalic acid Formula: C27H30N2O5 MolecularWeight: 462.5375

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O.C1=CC(=CC=C1C(=O)O)C(=O)O

Isomeric SMILES

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O.C1=CC(=CC=C1C(=O)O)C(=O)O

InChI

InChI=1S/C19H24N2O.C8H6O4/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17;9-7(10)5-1-2-6(4-3-5)8(11)12/h3-7,9,13-14,18-19,22H,2,8,10-12H2,1H3;1-4H,(H,9,10)(H,11,12)