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

Systemtic Name: 3-[2-[3-[(2-bromanyl-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]ethyl]piperidine-1-carboxamide Openeye Name: 3-[2-[3-[(2-bromo-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]ethyl]piperidine-1-carboxamide CAS Name: 3-[2-[3-[(2-bromo-5-methoxyphenyl)methyl]-1-pyrrolidinyl]ethyl]-1-piperidinecarboxamide IUPAC Name: 3-[2-[3-[(2-bromo-5-methoxyphenyl)methyl]pyrrolidin-1-yl]ethyl]piperidine-1-carboxamide Traditional Name: 3-[2-[3-(2-bromo-5-methoxy-benzyl)pyrrolidino]ethyl]piperidine-1-carboxamide Formula: C20H30BrN3O2 MolecularWeight: 424.3751

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CC2CCN(C2)CCC3CCCN(C3)C(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CC2CCN(C2)CCC3CCCN(C3)C(=O)N

InChI

InChI=1S/C20H30BrN3O2/c1-26-18-4-5-19(21)17(12-18)11-16-7-10-23(13-16)9-6-15-3-2-8-24(14-15)20(22)25/h4-5,12,15-16H,2-3,6-11,13-14H2,1H3,(H2,22,25)