ethanoic acid; 1-[6-(3-pyridin-3-ylpropoxy)-5-(trifluoromethyl)pyridin-2-yl]piperazine

Systemtic Name: ethanoic acid; 1-[6-(3-pyridin-3-ylpropoxy)-5-(trifluoromethyl)pyridin-2-yl]piperazine Openeye Name: acetic acid; 1-[6-[3-(3-pyridyl)propoxy]-5-(trifluoromethyl)-2-pyridyl]piperazine CAS Name: acetic acid; 1-[6-[3-(3-pyridinyl)propoxy]-5-(trifluoromethyl)-2-pyridinyl]piperazine IUPAC Name: acetic acid; 1-[6-(3-pyridin-3-ylpropoxy)-5-(trifluoromethyl)pyridin-2-yl]piperazine Traditional Name: acetic acid; 1-[6-[3-(3-pyridyl)propoxy]-5-(trifluoromethyl)-2-pyridyl]piperazine Formula: C20H25F3N4O3 MolecularWeight: 426.43271

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CN(CCN1)C2=NC(=C(C=C2)C(F)(F)F)OCCCC3=CN=CC=C3

Isomeric SMILES

CC(=O)O.C1CN(CCN1)C2=NC(=C(C=C2)C(F)(F)F)OCCCC3=CN=CC=C3

InChI

InChI=1S/C18H21F3N4O.C2H4O2/c19-18(20,21)15-5-6-16(25-10-8-22-9-11-25)24-17(15)26-12-2-4-14-3-1-7-23-13-14;1-2(3)4/h1,3,5-7,13,22H,2,4,8-12H2;1H3,(H,3,4)