[(2S)-6-methyl-3-oxidanylidene-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] 2-thiophen-2-ylethanoate

Systemtic Name: [(2S)-6-methyl-3-oxidanylidene-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] 2-thiophen-2-ylethanoate Openeye Name: [(2S)-6-methyl-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid [(2S)-6-methyl-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] ester IUPAC Name: [(2S)-6-methyl-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid [(2S)-3-keto-6-methyl-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] ester Formula: C16H12F3NO4S MolecularWeight: 371.33099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(C(=O)N2)(C(F)(F)F)OC(=O)CC3=CC=CS3

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@](C(=O)N2)(C(F)(F)F)OC(=O)CC3=CC=CS3

InChI

InChI=1S/C16H12F3NO4S/c1-9-4-5-12-11(7-9)20-14(22)15(23-12,16(17,18)19)24-13(21)8-10-3-2-6-25-10/h2-7H,8H2,1H3,(H,20,22)/t15-/m0/s1