2-azanyl-4-chloranyl-5-ethyl-benzenesulfonic acid

Systemtic Name: 2-azanyl-4-chloranyl-5-ethyl-benzenesulfonic acid Openeye Name: 2-amino-4-chloro-5-ethyl-benzenesulfonic acid CAS Name: 2-amino-4-chloro-5-ethylbenzenesulfonic acid IUPAC Name: 2-amino-4-chloro-5-ethylbenzenesulfonic acid Traditional Name: 2-amino-4-chloro-5-ethyl-besylic acid Formula: C8H10ClNO3S MolecularWeight: 235.6879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1Cl)N)S(=O)(=O)O

Isomeric SMILES

CCC1=CC(=C(C=C1Cl)N)S(=O)(=O)O

InChI

InChI=1S/C8H10ClNO3S/c1-2-5-3-8(14(11,12)13)7(10)4-6(5)9/h3-4H,2,10H2,1H3,(H,11,12,13)