ethyl (2S,3R)-6-azanyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: ethyl (2S,3R)-6-azanyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: ethyl (2S,3R)-6-amino-2-(trifluoromethyl)chromane-3-carboxylate CAS Name: (2S,3R)-6-amino-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-6-amino-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: (2S,3R)-6-amino-2-(trifluoromethyl)chroman-3-carboxylic acid ethyl ester Formula: C13H14F3NO3 MolecularWeight: 289.25037

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=C(C=CC(=C2)N)OC1C(F)(F)F

Isomeric SMILES

CCOC(=O)[C@@H]1CC2=C(C=CC(=C2)N)O[C@@H]1C(F)(F)F

InChI

InChI=1S/C13H14F3NO3/c1-2-19-12(18)9-6-7-5-8(17)3-4-10(7)20-11(9)13(14,15)16/h3-5,9,11H,2,6,17H2,1H3/t9-,11+/m1/s1