3-azanylpropane-1,2-diol; 1-nitro-4-(trifluoromethyl)benzene

Systemtic Name: 3-azanylpropane-1,2-diol; 1-nitro-4-(trifluoromethyl)benzene Openeye Name: 3-aminopropane-1,2-diol; 1-nitro-4-(trifluoromethyl)benzene CAS Name: 3-aminopropane-1,2-diol; 1-nitro-4-(trifluoromethyl)benzene IUPAC Name: 3-aminopropane-1,2-diol; 1-nitro-4-(trifluoromethyl)benzene Traditional Name: 3-aminopropane-1,2-diol; 1-nitro-4-(trifluoromethyl)benzene Formula: C10H13F3N2O4 MolecularWeight: 282.21643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)[N+](=O)[O-].C(C(CO)O)N

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)[N+](=O)[O-].C(C(CO)O)N

InChI

InChI=1S/C7H4F3NO2.C3H9NO2/c8-7(9,10)5-1-3-6(4-2-5)11(12)13;4-1-3(6)2-5/h1-4H;3,5-6H,1-2,4H2