azanium propan-2-yl benzenesulfonate

Systemtic Name: azanium propan-2-yl benzenesulfonate Openeye Name: ammonium isopropyl benzenesulfonate CAS Name: ammonium benzenesulfonic acid propan-2-yl ester IUPAC Name: azanium propan-2-yl benzenesulfonate Traditional Name: ammonium benzenesulfonic acid isopropyl ester Formula: C9H16NO3S+ MolecularWeight: 218.29324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OS(=O)(=O)C1=CC=CC=C1.[NH4+]

Isomeric SMILES

CC(C)OS(=O)(=O)C1=CC=CC=C1.[NH4+]

InChI

InChI=1S/C9H12O3S.H3N/c1-8(2)12-13(10,11)9-6-4-3-5-7-9;/h3-8H,1-2H3;1H3/p+1