[3-[(7-methoxy-6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)methyl]phenyl] ethanoate

Systemtic Name: [3-[(7-methoxy-6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)methyl]phenyl] ethanoate Openeye Name: [3-[(6-benzyloxy-7-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]phenyl] acetate CAS Name: acetic acid [3-[(7-methoxy-6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)methyl]phenyl] ester IUPAC Name: [3-[(7-methoxy-6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)methyl]phenyl] acetate Traditional Name: acetic acid [3-[(6-benzoxy-7-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]phenyl] ester Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)CC2=NCCC3=CC(=C(C=C32)OC)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)CC2=NCCC3=CC(=C(C=C32)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C26H25NO4/c1-18(28)31-22-10-6-9-20(13-22)14-24-23-16-25(29-2)26(15-21(23)11-12-27-24)30-17-19-7-4-3-5-8-19/h3-10,13,15-16H,11-12,14,17H2,1-2H3