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

Systemtic Name: 6-chloranyl-N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: 6-chloro-N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: 6-chloro-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: 6-chloro-N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-3-keto-4H-1,4-benzoxazine-7-sulfonamide Formula: C18H18ClFN2O5S MolecularWeight: 428.862323

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C18H18ClFN2O5S/c1-3-22(9-11-4-5-15(26-2)13(20)6-11)28(24,25)17-8-16-14(7-12(17)19)21-18(23)10-27-16/h4-8H,3,9-10H2,1-2H3,(H,21,23)