propan-2-yl 4-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyloxy]benzoate

Systemtic Name: propan-2-yl 4-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyloxy]benzoate Openeye Name: isopropyl 4-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyloxy]benzoate CAS Name: 4-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyloxy]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyloxy]benzoate Traditional Name: 4-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonyloxy]benzoic acid isopropyl ester Formula: C18H16ClNO7S MolecularWeight: 425.84014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C18H16ClNO7S/c1-10(2)26-18(22)11-3-5-12(6-4-11)27-28(23,24)16-8-15-14(7-13(16)19)20-17(21)9-25-15/h3-8,10H,9H2,1-2H3,(H,20,21)