2-(2,2-diphenylethanoyl)-7-methoxy-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(2,2-diphenylethanoyl)-7-methoxy-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 6-benzyloxy-2-(2,2-diphenylacetyl)-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 7-methoxy-2-(1-oxo-2,2-diphenylethyl)-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(2,2-diphenylacetyl)-7-methoxy-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 6-benzoxy-2-(2,2-diphenylacetyl)-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C32H29NO5 MolecularWeight: 507.57636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(N(CC2=C1)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2CC(N(CC2=C1)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C32H29NO5/c1-37-28-19-26-20-33(31(34)30(23-13-7-3-8-14-23)24-15-9-4-10-16-24)27(32(35)36)17-25(26)18-29(28)38-21-22-11-5-2-6-12-22/h2-16,18-19,27,30H,17,20-21H2,1H3,(H,35,36)