4-(4-methylsulfonylphenyl)isoquinoline

Systemtic Name: 4-(4-methylsulfonylphenyl)isoquinoline Openeye Name: 4-(4-methylsulfonylphenyl)isoquinoline CAS Name: 4-(4-methylsulfonylphenyl)isoquinoline IUPAC Name: 4-(4-methylsulfonylphenyl)isoquinoline Traditional Name: 4-(4-mesylphenyl)isoquinoline Formula: C16H13NO2S MolecularWeight: 283.34492

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=CC3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=CC3=CC=CC=C32

InChI

InChI=1S/C16H13NO2S/c1-20(18,19)14-8-6-12(7-9-14)16-11-17-10-13-4-2-3-5-15(13)16/h2-11H,1H3