3-[2-[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]ethyl]piperidine-1-carboxamide

Systemtic Name: 3-[2-[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]ethyl]piperidine-1-carboxamide Openeye Name: 3-[2-[4-[(2-bromo-5-methoxy-phenyl)methyl]-1-piperidyl]ethyl]piperidine-1-carboxamide CAS Name: 3-[2-[4-[(2-bromo-5-methoxyphenyl)methyl]-1-piperidinyl]ethyl]-1-piperidinecarboxamide IUPAC Name: 3-[2-[4-[(2-bromo-5-methoxyphenyl)methyl]piperidin-1-yl]ethyl]piperidine-1-carboxamide Traditional Name: 3-[2-[4-(2-bromo-5-methoxy-benzyl)piperidino]ethyl]piperidine-1-carboxamide Formula: C21H32BrN3O2 MolecularWeight: 438.40168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3CCCN(C3)C(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3CCCN(C3)C(=O)N

InChI

InChI=1S/C21H32BrN3O2/c1-27-19-4-5-20(22)18(14-19)13-16-6-10-24(11-7-16)12-8-17-3-2-9-25(15-17)21(23)26/h4-5,14,16-17H,2-3,6-13,15H2,1H3,(H2,23,26)