1-[3-[2-[4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidin-1-yl]ethyl]piperidin-1-yl]propan-1-one

Systemtic Name: 1-[3-[2-[4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidin-1-yl]ethyl]piperidin-1-yl]propan-1-one Openeye Name: 1-[3-[2-[4-[(2-bromo-5-isopropoxy-phenyl)methyl]-1-piperidyl]ethyl]-1-piperidyl]propan-1-one CAS Name: 1-[3-[2-[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]-1-piperidinyl]ethyl]-1-piperidinyl]-1-propanone IUPAC Name: 1-[3-[2-[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]piperidin-1-yl]ethyl]piperidin-1-yl]propan-1-one Traditional Name: 1-[3-[2-[4-(2-bromo-5-isopropoxy-benzyl)piperidino]ethyl]piperidino]propan-1-one Formula: C25H39BrN2O2 MolecularWeight: 479.49336

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCCC(C1)CCN2CCC(CC2)CC3=C(C=CC(=C3)OC(C)C)Br

Isomeric SMILES

CCC(=O)N1CCCC(C1)CCN2CCC(CC2)CC3=C(C=CC(=C3)OC(C)C)Br

InChI

InChI=1S/C25H39BrN2O2/c1-4-25(29)28-12-5-6-21(18-28)11-15-27-13-9-20(10-14-27)16-22-17-23(30-19(2)3)7-8-24(22)26/h7-8,17,19-21H,4-6,9-16,18H2,1-3H3