1-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl]-N-[3-(dimethylamino)-2,2-dimethyl-propyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl]-N-[3-(dimethylamino)-2,2-dimethyl-propyl]piperidine-4-carboxamide Openeye Name: 1-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methyl]-N-[3-(dimethylamino)-2,2-dimethyl-propyl]piperidine-4-carboxamide CAS Name: 1-[(3-bromo-4-hydroxy-5-methoxyphenyl)methyl]-N-[3-(dimethylamino)-2,2-dimethylpropyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromo-4-hydroxy-5-methoxyphenyl)methyl]-N-[3-(dimethylamino)-2,2-dimethylpropyl]piperidine-4-carboxamide Traditional Name: 1-(3-bromo-4-hydroxy-5-methoxy-benzyl)-N-[3-(dimethylamino)-2,2-dimethyl-propyl]isonipecotamide Formula: C21H34BrN3O3 MolecularWeight: 456.41696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)CC2=CC(=C(C(=C2)Br)O)OC)CN(C)C

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)CC2=CC(=C(C(=C2)Br)O)OC)CN(C)C

InChI

InChI=1S/C21H34BrN3O3/c1-21(2,14-24(3)4)13-23-20(27)16-6-8-25(9-7-16)12-15-10-17(22)19(26)18(11-15)28-5/h10-11,16,26H,6-9,12-14H2,1-5H3,(H,23,27)