ethyl (3R)-2-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: ethyl (3R)-2-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: ethyl (3R)-2-[(3-benzyloxy-4-methoxy-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3R)-2-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-(3-benzoxy-4-methoxy-benzyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid ethyl ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=CC=CC=C2CN1CC3=CC(=C(C=C3)OC)OCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@H]1CC2=CC=CC=C2CN1CC3=CC(=C(C=C3)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C27H29NO4/c1-3-31-27(29)24-16-22-11-7-8-12-23(22)18-28(24)17-21-13-14-25(30-2)26(15-21)32-19-20-9-5-4-6-10-20/h4-15,24H,3,16-19H2,1-2H3/t24-/m1/s1