1-[(4-cyanophenyl)methyl]-2-(phenylcarbonyl)isoquinoline-1-carbonitrile

Systemtic Name: 1-[(4-cyanophenyl)methyl]-2-(phenylcarbonyl)isoquinoline-1-carbonitrile Openeye Name: 2-benzoyl-1-[(4-cyanophenyl)methyl]isoquinoline-1-carbonitrile CAS Name: 2-benzoyl-1-[(4-cyanophenyl)methyl]-1-isoquinolinecarbonitrile IUPAC Name: 2-benzoyl-1-[(4-cyanophenyl)methyl]isoquinoline-1-carbonitrile Traditional Name: 2-benzoyl-1-(4-cyanobenzyl)isoquinoline-1-carbonitrile Formula: C25H17N3O MolecularWeight: 375.42198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N2C=CC3=CC=CC=C3C2(CC4=CC=C(C=C4)C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N2C=CC3=CC=CC=C3C2(CC4=CC=C(C=C4)C#N)C#N

InChI

InChI=1S/C25H17N3O/c26-17-20-12-10-19(11-13-20)16-25(18-27)23-9-5-4-6-21(23)14-15-28(25)24(29)22-7-2-1-3-8-22/h1-15H,16H2