[2-[methyl(propan-2-yl)amino]-2-oxidanylidene-ethyl]-(4-methylsulfonylphenyl)azanium

Systemtic Name: [2-[methyl(propan-2-yl)amino]-2-oxidanylidene-ethyl]-(4-methylsulfonylphenyl)azanium Openeye Name: [2-[isopropyl(methyl)amino]-2-oxo-ethyl]-(4-methylsulfonylphenyl)ammonium CAS Name: [2-[methyl(propan-2-yl)amino]-2-oxoethyl]-(4-methylsulfonylphenyl)ammonium IUPAC Name: [2-[methyl(propan-2-yl)amino]-2-oxoethyl]-(4-methylsulfonylphenyl)azanium Traditional Name: [2-[isopropyl(methyl)amino]-2-keto-ethyl]-(4-mesylphenyl)ammonium Formula: C13H21N2O3S+ MolecularWeight: 285.38244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C(=O)C[NH2+]C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

CC(C)N(C)C(=O)C[NH2+]C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C13H20N2O3S/c1-10(2)15(3)13(16)9-14-11-5-7-12(8-6-11)19(4,17)18/h5-8,10,14H,9H2,1-4H3/p+1