(2-methoxyphenyl) 3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonate

Systemtic Name: (2-methoxyphenyl) 3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonate Openeye Name: (2-methoxyphenyl) 3-oxo-4H-1,4-benzoxazine-6-sulfonate CAS Name: 3-oxo-4H-1,4-benzoxazine-6-sulfonic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 3-oxo-4H-1,4-benzoxazine-6-sulfonate Traditional Name: 3-keto-4H-1,4-benzoxazine-6-sulfonic acid (2-methoxyphenyl) ester Formula: C15H13NO6S MolecularWeight: 335.33182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

COC1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C15H13NO6S/c1-20-13-4-2-3-5-14(13)22-23(18,19)10-6-7-12-11(8-10)16-15(17)9-21-12/h2-8H,9H2,1H3,(H,16,17)