1-(4-bromanylphenoxy)-3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(4-bromanylphenoxy)-3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(4-bromophenoxy)-3-[4-(6-nitro-3-pyridyl)piperazin-1-yl]propan-2-ol CAS Name: 1-(4-bromophenoxy)-3-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-bromophenoxy)-3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propan-2-ol Traditional Name: 1-(4-bromophenoxy)-3-[4-(6-nitro-3-pyridyl)piperazino]propan-2-ol Formula: C18H21BrN4O4 MolecularWeight: 437.28774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)Br)O)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)Br)O)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21BrN4O4/c19-14-1-4-17(5-2-14)27-13-16(24)12-21-7-9-22(10-8-21)15-3-6-18(20-11-15)23(25)26/h1-6,11,16,24H,7-10,12-13H2