N-[(2,5-dimethoxyphenyl)methyl]-1-(2-phenylpyridin-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-1-(2-phenylpyridin-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-1-(2-phenylpyridine-4-carbonyl)piperidine-4-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-1-[oxo-(2-phenyl-4-pyridinyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-1-(2-phenylpyridine-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-1-(2-phenylisonicotinoyl)isonipecotamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC(=O)C2CCN(CC2)C(=O)C3=CC(=NC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC(=O)C2CCN(CC2)C(=O)C3=CC(=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4/c1-33-23-8-9-25(34-2)22(16-23)18-29-26(31)20-11-14-30(15-12-20)27(32)21-10-13-28-24(17-21)19-6-4-3-5-7-19/h3-10,13,16-17,20H,11-12,14-15,18H2,1-2H3,(H,29,31)