phenyl 2-(1-cyano-2-diazanyl-2-oxidanylidene-ethyl)-7-fluoranyl-4-oxidanyl-2H-chromene-3-sulfonate

Systemtic Name: phenyl 2-(1-cyano-2-diazanyl-2-oxidanylidene-ethyl)-7-fluoranyl-4-oxidanyl-2H-chromene-3-sulfonate Openeye Name: phenyl 2-(1-cyano-2-hydrazino-2-oxo-ethyl)-7-fluoro-4-hydroxy-2H-chromene-3-sulfonate CAS Name: 2-(1-cyano-2-hydrazinyl-2-oxoethyl)-7-fluoro-4-hydroxy-2H-1-benzopyran-3-sulfonic acid phenyl ester IUPAC Name: phenyl 2-(1-cyano-2-hydrazinyl-2-oxoethyl)-7-fluoro-4-hydroxy-2H-chromene-3-sulfonate Traditional Name: 2-(1-cyano-2-hydrazino-2-keto-ethyl)-7-fluoro-4-hydroxy-2H-chromene-3-sulfonic acid phenyl ester Formula: C18H14FN3O6S MolecularWeight: 419.383663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C3=C(C=C(C=C3)F)OC2C(C#N)C(=O)NN)O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C3=C(C=C(C=C3)F)OC2C(C#N)C(=O)NN)O

InChI

InChI=1S/C18H14FN3O6S/c19-10-6-7-12-14(8-10)27-16(13(9-20)18(24)22-21)17(15(12)23)29(25,26)28-11-4-2-1-3-5-11/h1-8,13,16,23H,21H2,(H,22,24)