6-methoxy-1-[[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]methyl]-2-(phenylcarbonyl)-7-phenylmethoxy-isoquinoline-1-carbonitrile

Systemtic Name: 6-methoxy-1-[[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]methyl]-2-(phenylcarbonyl)-7-phenylmethoxy-isoquinoline-1-carbonitrile Openeye Name: 2-benzoyl-7-benzyloxy-6-methoxy-1-[[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]methyl]isoquinoline-1-carbonitrile CAS Name: 2-benzoyl-6-methoxy-1-[[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]methyl]-7-phenylmethoxy-1-isoquinolinecarbonitrile IUPAC Name: 2-benzoyl-6-methoxy-1-[[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]methyl]-7-phenylmethoxyisoquinoline-1-carbonitrile Traditional Name: 7-benzoxy-2-benzoyl-6-methoxy-1-[2-(2-methyl-1,3-dioxolan-2-yl)benzyl]isoquinoline-1-carbonitrile Formula: C36H32N2O5 MolecularWeight: 572.64968

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)C2=CC=CC=C2CC3(C4=CC(=C(C=C4C=CN3C(=O)C5=CC=CC=C5)OC)OCC6=CC=CC=C6)C#N

Isomeric SMILES

CC1(OCCO1)C2=CC=CC=C2CC3(C4=CC(=C(C=C4C=CN3C(=O)C5=CC=CC=C5)OC)OCC6=CC=CC=C6)C#N

InChI

InChI=1S/C36H32N2O5/c1-35(42-19-20-43-35)30-16-10-9-15-29(30)23-36(25-37)31-22-33(41-24-26-11-5-3-6-12-26)32(40-2)21-28(31)17-18-38(36)34(39)27-13-7-4-8-14-27/h3-18,21-22H,19-20,23-24H2,1-2H3