6-chloranyl-N-[1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: 6-chloranyl-N-[1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: 6-chloro-N-[1-(3-fluoro-4-methoxy-phenyl)ethyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: 6-chloro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: 6-chloro-N-[1-(3-fluoro-4-methoxy-phenyl)ethyl]-3-keto-4H-1,4-benzoxazine-7-sulfonamide Formula: C17H16ClFN2O5S MolecularWeight: 414.835743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClFN2O5S/c1-9(10-3-4-14(25-2)12(19)5-10)21-27(23,24)16-7-15-13(6-11(16)18)20-17(22)8-26-15/h3-7,9,21H,8H2,1-2H3,(H,20,22)