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

Systemtic Name: 1-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]-3-(2-methylpropoxy)propan-2-ol Openeye Name: 1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]-3-isobutoxy-propan-2-ol CAS Name: 1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]-3-(2-methylpropoxy)-2-propanol IUPAC Name: 1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]-3-(2-methylpropoxy)propan-2-ol Traditional Name: 1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]-3-isobutoxy-propan-2-ol Formula: C18H27ClF3N3O2 MolecularWeight: 409.87409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC(CN1CCCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl)O

Isomeric SMILES

CC(C)COCC(CN1CCCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl)O

InChI

InChI=1S/C18H27ClF3N3O2/c1-13(2)11-27-12-15(26)10-24-4-3-5-25(7-6-24)17-16(19)8-14(9-23-17)18(20,21)22/h8-9,13,15,26H,3-7,10-12H2,1-2H3