furan-2-ylmethyl-[(2R)-7-methyl-3-oxidanylidene-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl]azanium

Systemtic Name: furan-2-ylmethyl-[(2R)-7-methyl-3-oxidanylidene-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl]azanium Openeye Name: 2-furylmethyl-[(2R)-7-methyl-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl]ammonium CAS Name: 2-furanylmethyl-[(2R)-7-methyl-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl]ammonium IUPAC Name: furan-2-ylmethyl-[(2R)-7-methyl-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl]azanium Traditional Name: 2-furfuryl-[(2R)-3-keto-7-methyl-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl]ammonium Formula: C15H14F3N2O3+ MolecularWeight: 327.27847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(O2)(C(F)(F)F)[NH2+]CC3=CC=CO3

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)[C@@](O2)(C(F)(F)F)[NH2+]CC3=CC=CO3

InChI

InChI=1S/C15H13F3N2O3/c1-9-4-5-11-12(7-9)23-14(13(21)20-11,15(16,17)18)19-8-10-3-2-6-22-10/h2-7,19H,8H2,1H3,(H,20,21)/p+1/t14-/m1/s1