6,7-dimethoxy-1-phenyl-4,4-bis(pyridin-4-ylmethyl)-3H-isoquinoline

Systemtic Name: 6,7-dimethoxy-1-phenyl-4,4-bis(pyridin-4-ylmethyl)-3H-isoquinoline Openeye Name: 6,7-dimethoxy-1-phenyl-4,4-bis(4-pyridylmethyl)-3H-isoquinoline CAS Name: 6,7-dimethoxy-1-phenyl-4,4-bis(pyridin-4-ylmethyl)-3H-isoquinoline IUPAC Name: 6,7-dimethoxy-1-phenyl-4,4-bis(pyridin-4-ylmethyl)-3H-isoquinoline Traditional Name: 6,7-dimethoxy-1-phenyl-4,4-bis(4-pyridylmethyl)-3H-isoquinoline Formula: C29H27N3O2 MolecularWeight: 449.54358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NCC2(CC3=CC=NC=C3)CC4=CC=NC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NCC2(CC3=CC=NC=C3)CC4=CC=NC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C29H27N3O2/c1-33-26-16-24-25(17-27(26)34-2)29(18-21-8-12-30-13-9-21,19-22-10-14-31-15-11-22)20-32-28(24)23-6-4-3-5-7-23/h3-17H,18-20H2,1-2H3