ethyl 4-[(2-ethanoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate

Systemtic Name: ethyl 4-[(2-ethanoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate Openeye Name: ethyl 4-[(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate CAS Name: 4-[(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate Traditional Name: 4-[(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoic acid ethyl ester Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2C(=O)C)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2C(=O)C)OC)OC

InChI

InChI=1S/C23H27NO6/c1-5-29-23(26)16-6-8-18(9-7-16)30-14-20-19-13-22(28-4)21(27-3)12-17(19)10-11-24(20)15(2)25/h6-9,12-13,20H,5,10-11,14H2,1-4H3