1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-3-(2-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: 1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-3-(2-propan-2-ylphenoxy)propan-2-ol Openeye Name: 1-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-3-(2-isopropylphenoxy)propan-2-ol CAS Name: 1-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-3-(2-propan-2-ylphenoxy)-2-propanol IUPAC Name: 1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-3-(2-propan-2-ylphenoxy)propan-2-ol Traditional Name: 1-[4-(5-bromo-2-pyridyl)piperazino]-3-(2-isopropylphenoxy)propan-2-ol Formula: C21H28BrN3O2 MolecularWeight: 434.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(CN2CCN(CC2)C3=NC=C(C=C3)Br)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(CN2CCN(CC2)C3=NC=C(C=C3)Br)O

InChI

InChI=1S/C21H28BrN3O2/c1-16(2)19-5-3-4-6-20(19)27-15-18(26)14-24-9-11-25(12-10-24)21-8-7-17(22)13-23-21/h3-8,13,16,18,26H,9-12,14-15H2,1-2H3