benzoic acid; 1-[phenethyl(trifluoromethyl)amino]propan-2-ol

Systemtic Name: benzoic acid; 1-[phenethyl(trifluoromethyl)amino]propan-2-ol Openeye Name: benzoic acid; 1-[phenethyl(trifluoromethyl)amino]propan-2-ol CAS Name: benzoic acid; 1-[phenethyl(trifluoromethyl)amino]-2-propanol IUPAC Name: benzoic acid; 1-[phenethyl(trifluoromethyl)amino]propan-2-ol Traditional Name: benzoic acid; 1-[phenethyl(trifluoromethyl)amino]propan-2-ol Formula: C19H22F3NO3 MolecularWeight: 369.37809

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CCC1=CC=CC=C1)C(F)(F)F)O.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(CN(CCC1=CC=CC=C1)C(F)(F)F)O.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H16F3NO.C7H6O2/c1-10(17)9-16(12(13,14)15)8-7-11-5-3-2-4-6-11;8-7(9)6-4-2-1-3-5-6/h2-6,10,17H,7-9H2,1H3;1-5H,(H,8,9)