2-arsonooctanoic acid; (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol

Systemtic Name: 2-arsonooctanoic acid; (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol Openeye Name: 2-arsonooctanoic acid; (6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methanol CAS Name: 2-arsonooctanoic acid; (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methanol IUPAC Name: 2-arsonooctanoic acid; (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol Traditional Name: 2-arsonocaprylic acid; (6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methanol Formula: C28H41AsN2O7 MolecularWeight: 592.55594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)[As](=O)(O)O.COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O

Isomeric SMILES

CCCCCCC(C(=O)O)[As](=O)(O)O.COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O

InChI

InChI=1S/C20H24N2O2.C8H17AsO5/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-2-3-4-5-6-7(8(10)11)9(12,13)14/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;7H,2-6H2,1H3,(H,10,11)(H2,12,13,14)