6-chloranyl-N-cyclohexyl-N-[(4-fluorophenyl)methyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: 6-chloranyl-N-cyclohexyl-N-[(4-fluorophenyl)methyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: 6-chloro-N-cyclohexyl-N-[(4-fluorophenyl)methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-cyclohexyl-N-[(4-fluorophenyl)methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: 6-chloro-N-cyclohexyl-N-[(4-fluorophenyl)methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: 6-chloro-N-cyclohexyl-N-(4-fluorobenzyl)-3-keto-4H-1,4-benzoxazine-7-sulfonamide Formula: C21H22ClFN2O4S MolecularWeight: 452.926783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=C(C=C2)F)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=C(C=C2)F)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

InChI

InChI=1S/C21H22ClFN2O4S/c22-17-10-18-19(29-13-21(26)24-18)11-20(17)30(27,28)25(16-4-2-1-3-5-16)12-14-6-8-15(23)9-7-14/h6-11,16H,1-5,12-13H2,(H,24,26)