(3,5-dimethylphenyl)-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3,5-dimethylphenyl)-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: (3,5-dimethylphenyl)-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]ammonium CAS Name: (3,5-dimethylphenyl)-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]ammonium IUPAC Name: (3,5-dimethylphenyl)-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: (3,5-dimethylphenyl)-[2-keto-2-(4-mesylpiperazino)ethyl]ammonium Formula: C15H24N3O3S+ MolecularWeight: 326.43436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)[NH2+]CC(=O)N2CCN(CC2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)[NH2+]CC(=O)N2CCN(CC2)S(=O)(=O)C)C

InChI

InChI=1S/C15H23N3O3S/c1-12-8-13(2)10-14(9-12)16-11-15(19)17-4-6-18(7-5-17)22(3,20)21/h8-10,16H,4-7,11H2,1-3H3/p+1