butylamino 2,4-dimethylbenzenesulfonate

Systemtic Name: butylamino 2,4-dimethylbenzenesulfonate Openeye Name: butylamino 2,4-dimethylbenzenesulfonate CAS Name: 2,4-dimethylbenzenesulfonic acid butylamino ester IUPAC Name: butylamino 2,4-dimethylbenzenesulfonate Traditional Name: 2,4-dimethylbenzenesulfonic acid butylamino ester Formula: C12H19NO3S MolecularWeight: 257.34916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNOS(=O)(=O)C1=C(C=C(C=C1)C)C

Isomeric SMILES

CCCCNOS(=O)(=O)C1=C(C=C(C=C1)C)C

InChI

InChI=1S/C12H19NO3S/c1-4-5-8-13-16-17(14,15)12-7-6-10(2)9-11(12)3/h6-7,9,13H,4-5,8H2,1-3H3