N-(4-benzamido-2,5-dimethoxy-phenyl)-1-(3-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-1-(3-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-(4-benzamido-2,5-dimethoxyphenyl)-1-[(3-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(4-benzamido-2,5-dimethoxyphenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-1-(3-fluorobenzoyl)isonipecotamide Formula: C28H28FN3O5 MolecularWeight: 505.537423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C3CCN(CC3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C3CCN(CC3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C28H28FN3O5/c1-36-24-17-23(25(37-2)16-22(24)30-26(33)18-7-4-3-5-8-18)31-27(34)19-11-13-32(14-12-19)28(35)20-9-6-10-21(29)15-20/h3-10,15-17,19H,11-14H2,1-2H3,(H,30,33)(H,31,34)