propyl 2-azanylbenzenesulfonate

Systemtic Name: propyl 2-azanylbenzenesulfonate Openeye Name: propyl 2-aminobenzenesulfonate CAS Name: 2-aminobenzenesulfonic acid propyl ester IUPAC Name: propyl 2-aminobenzenesulfonate Traditional Name: 2-aminobenzenesulfonic acid propyl ester Formula: C9H13NO3S MolecularWeight: 215.26942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)C1=CC=CC=C1N

Isomeric SMILES

CCCOS(=O)(=O)C1=CC=CC=C1N

InChI

InChI=1S/C9H13NO3S/c1-2-7-13-14(11,12)9-6-4-3-5-8(9)10/h3-6H,2,7,10H2,1H3