1-[(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methoxy]-4-[(5-ethyl-2-bicyclo[2.2.2]octanyl)-(6-methoxyquinolin-4-yl)methoxy]phthalazine

Systemtic Name: 1-[(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methoxy]-4-[(5-ethyl-2-bicyclo[2.2.2]octanyl)-(6-methoxyquinolin-4-yl)methoxy]phthalazine Openeye Name: 1-[(5-ethyl-2-bicyclo[2.2.2]octanyl)-(6-methoxy-4-quinolyl)methoxy]-4-[(5-ethylquinuclidin-2-yl)-(6-methoxy-4-quinolyl)methoxy]phthalazine CAS Name: 1-[(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methoxy]-4-[(5-ethyl-2-bicyclo[2.2.2]octanyl)-(6-methoxy-4-quinolinyl)methoxy]phthalazine IUPAC Name: 1-[(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methoxy]-4-[(5-ethyl-2-bicyclo[2.2.2]octanyl)-(6-methoxyquinolin-4-yl)methoxy]phthalazine Traditional Name: 1-[(5-ethyl-2-bicyclo[2.2.2]octanyl)-(6-methoxy-4-quinolyl)methoxy]-4-[(5-ethylquinuclidin-2-yl)-(6-methoxy-4-quinolyl)methoxy]phthalazine Formula: C49H55N5O4 MolecularWeight: 777.9921

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)OC5=NN=C(C6=CC=CC=C65)OC(C7CC8CCN7CC8CC)C9=C1C=C(C=CC1=NC=C9)OC

Isomeric SMILES

CCC1CC2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)OC5=NN=C(C6=CC=CC=C65)OC(C7CC8CCN7CC8CC)C9=C1C=C(C=CC1=NC=C9)OC

InChI

InChI=1S/C49H55N5O4/c1-5-29-23-33-12-11-31(29)24-40(33)46(36-17-20-50-43-15-13-34(55-3)26-41(36)43)57-48-38-9-7-8-10-39(38)49(53-52-48)58-47(45-25-32-19-22-54(45)28-30(32)6-2)37-18-21-51-44-16-14-35(56-4)27-42(37)44/h7-10,13-18,20-21,26-27,29-33,40,45-47H,5-6,11-12,19,22-25,28H2,1-4H3