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

Systemtic Name: 1-[4-[2-[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]ethyl]piperidin-1-yl]propan-1-one Openeye Name: 1-[4-[2-[4-[(2-bromo-5-methoxy-phenyl)methyl]-1-piperidyl]ethyl]-1-piperidyl]propan-1-one CAS Name: 1-[4-[2-[4-[(2-bromo-5-methoxyphenyl)methyl]-1-piperidinyl]ethyl]-1-piperidinyl]-1-propanone IUPAC Name: 1-[4-[2-[4-[(2-bromo-5-methoxyphenyl)methyl]piperidin-1-yl]ethyl]piperidin-1-yl]propan-1-one Traditional Name: 1-[4-[2-[4-(2-bromo-5-methoxy-benzyl)piperidino]ethyl]piperidino]propan-1-one Formula: C23H35BrN2O2 MolecularWeight: 451.4402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1)CCN2CCC(CC2)CC3=C(C=CC(=C3)OC)Br

Isomeric SMILES

CCC(=O)N1CCC(CC1)CCN2CCC(CC2)CC3=C(C=CC(=C3)OC)Br

InChI

InChI=1S/C23H35BrN2O2/c1-3-23(27)26-14-9-18(10-15-26)6-11-25-12-7-19(8-13-25)16-20-17-21(28-2)4-5-22(20)24/h4-5,17-19H,3,6-16H2,1-2H3