3-methyl-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]butan-1-ol

Systemtic Name: 3-methyl-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]butan-1-ol Openeye Name: 3-methyl-3-[2-nitro-4-(trifluoromethyl)anilino]butan-1-ol CAS Name: 3-methyl-3-[2-nitro-4-(trifluoromethyl)anilino]-1-butanol IUPAC Name: 3-methyl-3-[2-nitro-4-(trifluoromethyl)anilino]butan-1-ol Traditional Name: 3-methyl-3-[2-nitro-4-(trifluoromethyl)anilino]butan-1-ol Formula: C12H15F3N2O3 MolecularWeight: 292.25431

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCO)NC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CCO)NC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H15F3N2O3/c1-11(2,5-6-18)16-9-4-3-8(12(13,14)15)7-10(9)17(19)20/h3-4,7,16,18H,5-6H2,1-2H3