(7-methoxy-6-methyl-5-phenylmethoxy-isoquinolin-1-yl)methyl ethanoate

Systemtic Name: (7-methoxy-6-methyl-5-phenylmethoxy-isoquinolin-1-yl)methyl ethanoate Openeye Name: (5-benzyloxy-7-methoxy-6-methyl-1-isoquinolyl)methyl acetate CAS Name: acetic acid (7-methoxy-6-methyl-5-phenylmethoxy-1-isoquinolinyl)methyl ester IUPAC Name: (7-methoxy-6-methyl-5-phenylmethoxyisoquinolin-1-yl)methyl acetate Traditional Name: acetic acid (5-benzoxy-7-methoxy-6-methyl-1-isoquinolyl)methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1OCC3=CC=CC=C3)C=CN=C2COC(=O)C)OC

Isomeric SMILES

CC1=C(C=C2C(=C1OCC3=CC=CC=C3)C=CN=C2COC(=O)C)OC

InChI

InChI=1S/C21H21NO4/c1-14-20(24-3)11-18-17(9-10-22-19(18)13-25-15(2)23)21(14)26-12-16-7-5-4-6-8-16/h4-11H,12-13H2,1-3H3