methyl 3-[2-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethoxy]benzoate

Systemtic Name: methyl 3-[2-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethoxy]benzoate Openeye Name: methyl 3-[2-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethoxy]benzoate CAS Name: 3-[2-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethoxy]benzoate Traditional Name: 3-[2-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethoxy]benzoic acid methyl ester Formula: C18H17ClN2O7S MolecularWeight: 440.85478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCCNS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCCNS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C18H17ClN2O7S/c1-26-18(23)11-3-2-4-12(7-11)27-6-5-20-29(24,25)16-9-15-14(8-13(16)19)21-17(22)10-28-15/h2-4,7-9,20H,5-6,10H2,1H3,(H,21,22)