azanium methyl 4-methylbenzenesulfonate

Systemtic Name: azanium methyl 4-methylbenzenesulfonate Openeye Name: ammonium methyl 4-methylbenzenesulfonate CAS Name: ammonium 4-methylbenzenesulfonic acid methyl ester IUPAC Name: azanium methyl 4-methylbenzenesulfonate Traditional Name: ammonium 4-methylbenzenesulfonic acid methyl ester Formula: C8H14NO3S+ MolecularWeight: 204.26666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC.[NH4+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC.[NH4+]

InChI

InChI=1S/C8H10O3S.H3N/c1-7-3-5-8(6-4-7)12(9,10)11-2;/h3-6H,1-2H3;1H3/p+1