[8-methoxy-1-methyl-7-(phenylcarbonyloxy)-1,2,3,4-tetrahydroisoquinolin-6-yl] benzoate

Systemtic Name: [8-methoxy-1-methyl-7-(phenylcarbonyloxy)-1,2,3,4-tetrahydroisoquinolin-6-yl] benzoate Openeye Name: (7-benzoyloxy-8-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-6-yl) benzoate CAS Name: benzoic acid (7-benzoyloxy-8-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-6-yl) ester IUPAC Name: (7-benzoyloxy-8-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-6-yl) benzoate Traditional Name: benzoic acid (7-benzoyloxy-8-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-6-yl) ester Formula: C25H23NO5 MolecularWeight: 417.45382

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C(=C(C=C2CCN1)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC

Isomeric SMILES

CC1C2=C(C(=C(C=C2CCN1)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H23NO5/c1-16-21-19(13-14-26-16)15-20(30-24(27)17-9-5-3-6-10-17)22(23(21)29-2)31-25(28)18-11-7-4-8-12-18/h3-12,15-16,26H,13-14H2,1-2H3