dimethylamino 4-methylbenzenesulfonate

Systemtic Name: dimethylamino 4-methylbenzenesulfonate Openeye Name: dimethylamino 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid dimethylamino ester IUPAC Name: dimethylamino 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid dimethylamino ester Formula: C9H13NO3S MolecularWeight: 215.26942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ON(C)C

InChI

InChI=1S/C9H13NO3S/c1-8-4-6-9(7-5-8)14(11,12)13-10(2)3/h4-7H,1-3H3