N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-(4-fluorophenyl)carbonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-(4-fluorophenyl)carbonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-1-(4-fluorobenzoyl)-N-methyl-piperidine-4-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-[(4-fluorophenyl)-oxomethyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-(4-fluorobenzoyl)-N-methylpiperidine-4-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-1-(4-fluorobenzoyl)-N-methyl-isonipecotamide Formula: C22H24BrFN2O3 MolecularWeight: 463.339963

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24BrFN2O3/c1-25(14-17-13-18(23)5-8-20(17)29-2)21(27)16-9-11-26(12-10-16)22(28)15-3-6-19(24)7-4-15/h3-8,13,16H,9-12,14H2,1-2H3