2-[(5-bromanyl-2-methoxy-phenyl)methylamino]-N-ethyl-3-phenyl-piperidine-1-carboxamide

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methylamino]-N-ethyl-3-phenyl-piperidine-1-carboxamide Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methylamino]-N-ethyl-3-phenyl-piperidine-1-carboxamide CAS Name: 2-[(5-bromo-2-methoxyphenyl)methylamino]-N-ethyl-3-phenyl-1-piperidinecarboxamide IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methylamino]-N-ethyl-3-phenylpiperidine-1-carboxamide Traditional Name: 2-[(5-bromo-2-methoxy-benzyl)amino]-N-ethyl-3-phenyl-piperidine-1-carboxamide Formula: C22H28BrN3O2 MolecularWeight: 446.38062

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCCC(C1NCC2=C(C=CC(=C2)Br)OC)C3=CC=CC=C3

Isomeric SMILES

CCNC(=O)N1CCCC(C1NCC2=C(C=CC(=C2)Br)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H28BrN3O2/c1-3-24-22(27)26-13-7-10-19(16-8-5-4-6-9-16)21(26)25-15-17-14-18(23)11-12-20(17)28-2/h4-6,8-9,11-12,14,19,21,25H,3,7,10,13,15H2,1-2H3,(H,24,27)