3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-(4-methylphenyl)sulfonyl-propanenitrile

Systemtic Name: 3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-(4-methylphenyl)sulfonyl-propanenitrile Openeye Name: 3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-(p-tolylsulfonyl)propanenitrile CAS Name: 3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-(4-methylphenyl)sulfonylpropanenitrile IUPAC Name: 3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-(4-methylphenyl)sulfonylpropanenitrile Traditional Name: 3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-tosyl-propionitrile Formula: C15H19NO4S MolecularWeight: 309.38066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC2COC(O2)(C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C[C@H]2COC(O2)(C)C)C#N

InChI

InChI=1S/C15H19NO4S/c1-11-4-6-13(7-5-11)21(17,18)14(9-16)8-12-10-19-15(2,3)20-12/h4-7,12,14H,8,10H2,1-3H3/t12-,14?/m0/s1