1-prop-2-ynoxy-3-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propan-2-ol

Systemtic Name: 1-prop-2-ynoxy-3-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propan-2-ol Openeye Name: 1-prop-2-ynoxy-3-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]propan-2-ol CAS Name: 1-prop-2-ynoxy-3-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]-2-propanol IUPAC Name: 1-prop-2-ynoxy-3-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propan-2-ol Traditional Name: 1-propargyloxy-3-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]propan-2-ol Formula: C17H22F3N3O2 MolecularWeight: 357.37069

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOCC(CN1CCCN(CC1)C2=NC=C(C=C2)C(F)(F)F)O

Isomeric SMILES

C#CCOCC(CN1CCCN(CC1)C2=NC=C(C=C2)C(F)(F)F)O

InChI

InChI=1S/C17H22F3N3O2/c1-2-10-25-13-15(24)12-22-6-3-7-23(9-8-22)16-5-4-14(11-21-16)17(18,19)20/h1,4-5,11,15,24H,3,6-10,12-13H2