5-(dipropylamino)-4-fluoranyl-2-[(5-methyl-1,2-oxazol-3-yl)diazenyl]benzenesulfonic acid

Systemtic Name: 5-(dipropylamino)-4-fluoranyl-2-[(5-methyl-1,2-oxazol-3-yl)diazenyl]benzenesulfonic acid Openeye Name: 5-(dipropylamino)-4-fluoro-2-(5-methylisoxazol-3-yl)azo-benzenesulfonic acid CAS Name: 5-(dipropylamino)-4-fluoro-2-[(5-methyl-3-isoxazolyl)azo]benzenesulfonic acid IUPAC Name: 5-(dipropylamino)-4-fluoro-2-[(5-methyl-1,2-oxazol-3-yl)diazenyl]benzenesulfonic acid Traditional Name: 5-(dipropylamino)-4-fluoro-2-(5-methylisoxazol-3-yl)azo-besylic acid Formula: C16H21FN4O4S MolecularWeight: 384.425743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C=C(C(=C1)S(=O)(=O)O)N=NC2=NOC(=C2)C)F

Isomeric SMILES

CCCN(CCC)C1=C(C=C(C(=C1)S(=O)(=O)O)N=NC2=NOC(=C2)C)F

InChI

InChI=1S/C16H21FN4O4S/c1-4-6-21(7-5-2)14-10-15(26(22,23)24)13(9-12(14)17)18-19-16-8-11(3)25-20-16/h8-10H,4-7H2,1-3H3,(H,22,23,24)