(2R)-3-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methyl-propanenitrile

Systemtic Name: (2R)-3-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methyl-propanenitrile Openeye Name: (2R)-3-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methyl-propanenitrile CAS Name: (2R)-3-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-methylpropanenitrile IUPAC Name: (2R)-3-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methylpropanenitrile Traditional Name: (2R)-3-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-methyl-propionitrile Formula: C16H23N3O4S MolecularWeight: 353.43652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC)C#N

Isomeric SMILES

C[C@H](CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC)C#N

InChI

InChI=1S/C16H23N3O4S/c1-13(11-17)12-18-6-8-19(9-7-18)24(20,21)14-4-5-15(22-2)16(10-14)23-3/h4-5,10,13H,6-9,12H2,1-3H3/t13-/m0/s1