N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-4-phenoxy-benzamide

Systemtic Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-4-phenoxy-benzamide Openeye Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-4-phenoxy-benzamide CAS Name: N-[2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl]-4-phenoxybenzamide IUPAC Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-4-phenoxybenzamide Traditional Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-4-phenoxy-benzamide Formula: C33H30N2O6 MolecularWeight: 550.6011

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)C4=CC=C(C=C4)OC5=CC=CC=C5)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)C4=CC=C(C=C4)OC5=CC=CC=C5)OC)OC)OC

InChI

InChI=1S/C33H30N2O6/c1-37-29-17-22-14-15-34-28(26(22)19-31(29)39-3)16-23-18-30(38-2)32(40-4)20-27(23)35-33(36)21-10-12-25(13-11-21)41-24-8-6-5-7-9-24/h5-15,17-20H,16H2,1-4H3,(H,35,36)