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(2S,3R)-3-methyl-2-[[4-nitro-3-(trifluoromethyl)phenyl]amino]pentan-1-ol
(2S,3R)-3-methyl-2-[[4-nitro-3-(trifluoromethyl)phenyl]amino]pentan-1-ol
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Descriptors Computed from Structure
Canonical SMILES:
CCC(C)C(CO)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F
Isomeric SMILES
CC[C@@H](C)[C@@H](CO)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F
InChI
InChI=1S/C13H17F3N2O3/c1-3-8(2)11(7-19)17-9-4-5-12(18(20)21)10(6-9)13(14,15)16/h4-6,8,11,17,19H,3,7H2,1-2H3/t8-,11-/m1/s1
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