4-[[5-[(7-iodanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[(7-iodanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[(7-iodo-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[(7-iodo-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[(7-iodo-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[(7-iodo-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzonitrile Formula: C21H19IN4 MolecularWeight: 454.30683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)I)CC3=CN=CN3CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)I)CC3=CN=CN3CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H19IN4/c22-20-6-5-18-7-8-25(13-19(18)9-20)14-21-11-24-15-26(21)12-17-3-1-16(10-23)2-4-17/h1-6,9,11,15H,7-8,12-14H2