N-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-keto-6-methyl-4H-1,4-benzoxazine-7-sulfonamide Formula: C17H12F6N2O4S MolecularWeight: 454.343599

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)OCC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)OCC(=O)N2

InChI

InChI=1S/C17H12F6N2O4S/c1-8-2-12-13(29-7-15(26)24-12)6-14(8)30(27,28)25-11-4-9(16(18,19)20)3-10(5-11)17(21,22)23/h2-6,25H,7H2,1H3,(H,24,26)