2-(phenylcarbonyl)-1-propan-2-yl-isoquinoline-1-carbonitrile

Systemtic Name: 2-(phenylcarbonyl)-1-propan-2-yl-isoquinoline-1-carbonitrile Openeye Name: 2-benzoyl-1-isopropyl-isoquinoline-1-carbonitrile CAS Name: 2-benzoyl-1-propan-2-yl-1-isoquinolinecarbonitrile IUPAC Name: 2-benzoyl-1-propan-2-ylisoquinoline-1-carbonitrile Traditional Name: 2-benzoyl-1-isopropyl-isoquinoline-1-carbonitrile Formula: C20H18N2O MolecularWeight: 302.36972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C2=CC=CC=C2C=CN1C(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)C1(C2=CC=CC=C2C=CN1C(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C20H18N2O/c1-15(2)20(14-21)18-11-7-6-8-16(18)12-13-22(20)19(23)17-9-4-3-5-10-17/h3-13,15H,1-2H3