2-[(R)-(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methoxy]ethanoate

Systemtic Name: 2-[(R)-(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methoxy]ethanoate Openeye Name: 2-[(R)-(6,7-dimethoxy-1-isoquinolyl)-(3,4-dimethoxyphenyl)methoxy]acetate CAS Name: 2-[(R)-(6,7-dimethoxy-1-isoquinolinyl)-(3,4-dimethoxyphenyl)methoxy]acetate IUPAC Name: 2-[(R)-(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methoxy]acetate Traditional Name: 2-[(R)-(6,7-dimethoxy-1-isoquinolyl)-(3,4-dimethoxyphenyl)methoxy]acetate Formula: C22H22NO7- MolecularWeight: 412.41258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=NC=CC3=CC(=C(C=C32)OC)OC)OCC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](C2=NC=CC3=CC(=C(C=C32)OC)OC)OCC(=O)[O-])OC

InChI

InChI=1S/C22H23NO7/c1-26-16-6-5-14(10-17(16)27-2)22(30-12-20(24)25)21-15-11-19(29-4)18(28-3)9-13(15)7-8-23-21/h5-11,22H,12H2,1-4H3,(H,24,25)/p-1/t22-/m1/s1