3-fluoranyl-4-isoquinolin-5-ylsulfonyl-benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-isoquinolin-5-ylsulfonyl-benzenecarbonitrile Openeye Name: 3-fluoro-4-(5-isoquinolylsulfonyl)benzonitrile CAS Name: 3-fluoro-4-(5-isoquinolinylsulfonyl)benzonitrile IUPAC Name: 3-fluoro-4-isoquinolin-5-ylsulfonylbenzonitrile Traditional Name: 3-fluoro-4-(5-isoquinolylsulfonyl)benzonitrile Formula: C16H9FN2O2S MolecularWeight: 312.318263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)C3=C(C=C(C=C3)C#N)F

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)C3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C16H9FN2O2S/c17-14-8-11(9-18)4-5-16(14)22(20,21)15-3-1-2-12-10-19-7-6-13(12)15/h1-8,10H