3-[methyl(phenyl)amino]propane-1-sulfonic acid

Systemtic Name: 3-[methyl(phenyl)amino]propane-1-sulfonic acid Openeye Name: 3-(N-methylanilino)propane-1-sulfonic acid CAS Name: 3-(N-methylanilino)-1-propanesulfonic acid IUPAC Name: 3-(N-methylanilino)propane-1-sulfonic acid Traditional Name: 3-(N-methylanilino)propane-1-sulfonic acid Formula: C10H15NO3S MolecularWeight: 229.296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCS(=O)(=O)O)C1=CC=CC=C1

Isomeric SMILES

CN(CCCS(=O)(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C10H15NO3S/c1-11(8-5-9-15(12,13)14)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H,12,13,14)