3-(4-azanyl-3-methyl-phenoxy)propane-1-sulfonic acid

Systemtic Name: 3-(4-azanyl-3-methyl-phenoxy)propane-1-sulfonic acid Openeye Name: 3-(4-amino-3-methyl-phenoxy)propane-1-sulfonic acid CAS Name: 3-(4-amino-3-methylphenoxy)-1-propanesulfonic acid IUPAC Name: 3-(4-amino-3-methylphenoxy)propane-1-sulfonic acid Traditional Name: 3-(4-amino-3-methyl-phenoxy)propane-1-sulfonic acid Formula: C10H15NO4S MolecularWeight: 245.2954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCS(=O)(=O)O)N

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCS(=O)(=O)O)N

InChI

InChI=1S/C10H15NO4S/c1-8-7-9(3-4-10(8)11)15-5-2-6-16(12,13)14/h3-4,7H,2,5-6,11H2,1H3,(H,12,13,14)