N-(4-bromanyl-2-fluoranyl-phenyl)-1-(3,4-dimethoxyphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-(3,4-dimethoxyphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-(3,4-dimethoxybenzoyl)piperidine-4-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[(3,4-dimethoxyphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-(3,4-dimethoxybenzoyl)piperidine-4-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-veratroyl-isonipecotamide Formula: C21H22BrFN2O4 MolecularWeight: 465.312783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)Br)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)Br)F)OC

InChI

InChI=1S/C21H22BrFN2O4/c1-28-18-6-3-14(11-19(18)29-2)21(27)25-9-7-13(8-10-25)20(26)24-17-5-4-15(22)12-16(17)23/h3-6,11-13H,7-10H2,1-2H3,(H,24,26)