3-[8-(4-iodophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]benzenecarbonitrile

Systemtic Name: 3-[8-(4-iodophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]benzenecarbonitrile Openeye Name: 3-[8-(4-iodophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]benzonitrile CAS Name: 3-[8-(4-iodophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]benzonitrile IUPAC Name: 3-[8-(4-iodophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]benzonitrile Traditional Name: 3-[8-(4-iodophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]benzonitrile Formula: C22H17IN2 MolecularWeight: 436.28825

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C(C=CC=C21)C3=CC=C(C=C3)I)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CC2=C(C=CC=C21)C3=CC=C(C=C3)I)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H17IN2/c23-19-9-7-18(8-10-19)21-6-2-4-17-11-12-25(15-22(17)21)20-5-1-3-16(13-20)14-24/h1-10,13H,11-12,15H2