3-phenyl-2-(phenylsulfonyl)heptanenitrile

Systemtic Name: 3-phenyl-2-(phenylsulfonyl)heptanenitrile Openeye Name: 2-(benzenesulfonyl)-3-phenyl-heptanenitrile CAS Name: 2-(benzenesulfonyl)-3-phenylheptanenitrile IUPAC Name: 2-(benzenesulfonyl)-3-phenylheptanenitrile Traditional Name: 2-besyl-3-phenyl-enanthonitrile Formula: C19H21NO2S MolecularWeight: 327.44054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(C1=CC=CC=C1)C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H21NO2S/c1-2-3-14-18(16-10-6-4-7-11-16)19(15-20)23(21,22)17-12-8-5-9-13-17/h4-13,18-19H,2-3,14H2,1H3