(phenylmethyl) 7-methoxy-1-methyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: (phenylmethyl) 7-methoxy-1-methyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: benzyl 6-benzyloxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 7-methoxy-1-methyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-methoxy-1-methyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-benzoxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1C(=O)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1C(=O)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C26H27NO4/c1-19-23-16-24(29-2)25(30-17-20-9-5-3-6-10-20)15-22(23)13-14-27(19)26(28)31-18-21-11-7-4-8-12-21/h3-12,15-16,19H,13-14,17-18H2,1-2H3