(4-phenoxyphenyl) 6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonate

Systemtic Name: (4-phenoxyphenyl) 6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonate Openeye Name: (4-phenoxyphenyl) 6-chloro-3-oxo-4H-1,4-benzoxazine-7-sulfonate CAS Name: 6-chloro-3-oxo-4H-1,4-benzoxazine-7-sulfonic acid (4-phenoxyphenyl) ester IUPAC Name: (4-phenoxyphenyl) 6-chloro-3-oxo-4H-1,4-benzoxazine-7-sulfonate Traditional Name: 6-chloro-3-keto-4H-1,4-benzoxazine-7-sulfonic acid (4-phenoxyphenyl) ester Formula: C20H14ClNO6S MolecularWeight: 431.84626

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC(=C(C=C2O1)S(=O)(=O)OC3=CC=C(C=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

C1C(=O)NC2=CC(=C(C=C2O1)S(=O)(=O)OC3=CC=C(C=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C20H14ClNO6S/c21-16-10-17-18(26-12-20(23)22-17)11-19(16)29(24,25)28-15-8-6-14(7-9-15)27-13-4-2-1-3-5-13/h1-11H,12H2,(H,22,23)