1-[(2,5-dimethoxyphenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(2,5-dimethoxyphenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,5-dimethoxyphenyl)-(3-fluoro-4-methoxy-phenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,5-dimethoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,5-dimethoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,5-dimethoxyphenyl)-(3-fluoro-4-methoxy-phenyl)methyl]pipecolinic acid Formula: C22H26FNO5 MolecularWeight: 403.443943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(C2=CC(=C(C=C2)OC)F)N3CCCCC3C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(C2=CC(=C(C=C2)OC)F)N3CCCCC3C(=O)O

InChI

InChI=1S/C22H26FNO5/c1-27-15-8-10-19(28-2)16(13-15)21(14-7-9-20(29-3)17(23)12-14)24-11-5-4-6-18(24)22(25)26/h7-10,12-13,18,21H,4-6,11H2,1-3H3,(H,25,26)