4-(3-pent-4-enyl-4-phenyl-isoquinolin-1-yl)benzenecarbonitrile

Systemtic Name: 4-(3-pent-4-enyl-4-phenyl-isoquinolin-1-yl)benzenecarbonitrile Openeye Name: 4-(3-pent-4-enyl-4-phenyl-1-isoquinolyl)benzonitrile CAS Name: 4-(3-pent-4-enyl-4-phenyl-1-isoquinolinyl)benzonitrile IUPAC Name: 4-(3-pent-4-enyl-4-phenylisoquinolin-1-yl)benzonitrile Traditional Name: 4-(3-pent-4-enyl-4-phenyl-1-isoquinolyl)benzonitrile Formula: C27H22N2 MolecularWeight: 374.47698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC1=C(C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

C=CCCCC1=C(C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C27H22N2/c1-2-3-5-14-25-26(21-10-6-4-7-11-21)23-12-8-9-13-24(23)27(29-25)22-17-15-20(19-28)16-18-22/h2,4,6-13,15-18H,1,3,5,14H2