2-(phenylsulfonyl)-1H-isoquinoline-1-carbonitrile

Systemtic Name: 2-(phenylsulfonyl)-1H-isoquinoline-1-carbonitrile Openeye Name: 2-(benzenesulfonyl)-1H-isoquinoline-1-carbonitrile CAS Name: 2-(benzenesulfonyl)-1H-isoquinoline-1-carbonitrile IUPAC Name: 2-(benzenesulfonyl)-1H-isoquinoline-1-carbonitrile Traditional Name: 2-besyl-1H-isoquinoline-1-carbonitrile Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=CC=CC=C3C2C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=CC=CC=C3C2C#N

InChI

InChI=1S/C16H12N2O2S/c17-12-16-15-9-5-4-6-13(15)10-11-18(16)21(19,20)14-7-2-1-3-8-14/h1-11,16H