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

Systemtic Name: 5-(diethylamino)-2-[(5-ethyl-1,2-oxazol-3-yl)diazenyl]-4-fluoranyl-benzenesulfonic acid Openeye Name: 5-(diethylamino)-2-(5-ethylisoxazol-3-yl)azo-4-fluoro-benzenesulfonic acid CAS Name: 5-(diethylamino)-2-[(5-ethyl-3-isoxazolyl)azo]-4-fluorobenzenesulfonic acid IUPAC Name: 5-(diethylamino)-2-[(5-ethyl-1,2-oxazol-3-yl)diazenyl]-4-fluorobenzenesulfonic acid Traditional Name: 5-(diethylamino)-2-(5-ethylisoxazol-3-yl)azo-4-fluoro-besylic acid Formula: C15H19FN4O4S MolecularWeight: 370.399163

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NO1)N=NC2=CC(=C(C=C2S(=O)(=O)O)N(CC)CC)F

Isomeric SMILES

CCC1=CC(=NO1)N=NC2=CC(=C(C=C2S(=O)(=O)O)N(CC)CC)F

InChI

InChI=1S/C15H19FN4O4S/c1-4-10-7-15(19-24-10)18-17-12-8-11(16)13(20(5-2)6-3)9-14(12)25(21,22)23/h7-9H,4-6H2,1-3H3,(H,21,22,23)