3-(dimethoxymethyl)-4-methyl-4-(4-methylphenyl)sulfonyl-pentanenitrile

Systemtic Name: 3-(dimethoxymethyl)-4-methyl-4-(4-methylphenyl)sulfonyl-pentanenitrile Openeye Name: 3-(dimethoxymethyl)-4-methyl-4-(p-tolylsulfonyl)pentanenitrile CAS Name: 3-(dimethoxymethyl)-4-methyl-4-(4-methylphenyl)sulfonylpentanenitrile IUPAC Name: 3-(dimethoxymethyl)-4-methyl-4-(4-methylphenyl)sulfonylpentanenitrile Traditional Name: 3-(dimethoxymethyl)-4-methyl-4-tosyl-valeronitrile Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C)(C)C(CC#N)C(OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C)(C)C(CC#N)C(OC)OC

InChI

InChI=1S/C16H23NO4S/c1-12-6-8-13(9-7-12)22(18,19)16(2,3)14(10-11-17)15(20-4)21-5/h6-9,14-15H,10H2,1-5H3