methyl (2R)-4-[4-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: methyl (2R)-4-[4-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: methyl (2R)-4-[4-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: (2R)-4-[4-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[4-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: (2R)-4-[4-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid methyl ester Formula: C17H14F3NO5S MolecularWeight: 401.35697

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(C2=CC=CC=C2O1)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC(=O)[C@H]1CN(C2=CC=CC=C2O1)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H14F3NO5S/c1-25-16(22)15-10-21(13-4-2-3-5-14(13)26-15)27(23,24)12-8-6-11(7-9-12)17(18,19)20/h2-9,15H,10H2,1H3/t15-/m1/s1