1-(diphenylmethyl)-6,7-dimethoxy-2-(phenylcarbonyl)isoquinoline-1-carbonitrile

Systemtic Name: 1-(diphenylmethyl)-6,7-dimethoxy-2-(phenylcarbonyl)isoquinoline-1-carbonitrile Openeye Name: 1-benzhydryl-2-benzoyl-6,7-dimethoxy-isoquinoline-1-carbonitrile CAS Name: 2-benzoyl-1-(diphenylmethyl)-6,7-dimethoxy-1-isoquinolinecarbonitrile IUPAC Name: 1-benzhydryl-2-benzoyl-6,7-dimethoxyisoquinoline-1-carbonitrile Traditional Name: 1-benzhydryl-2-benzoyl-6,7-dimethoxy-isoquinoline-1-carbonitrile Formula: C32H26N2O3 MolecularWeight: 486.56044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN(C2(C#N)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN(C2(C#N)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C32H26N2O3/c1-36-28-20-26-18-19-34(31(35)25-16-10-5-11-17-25)32(22-33,27(26)21-29(28)37-2)30(23-12-6-3-7-13-23)24-14-8-4-9-15-24/h3-21,30H,1-2H3