1-[(2,4-dimethoxyphenyl)-(furan-2-yl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2,4-dimethoxyphenyl)-(furan-2-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4-dimethoxyphenyl)-(2-furyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,4-dimethoxyphenyl)-(2-furanyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dimethoxyphenyl)-(furan-2-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,4-dimethoxyphenyl)-(2-furyl)methyl]nipecotic acid Formula: C19H23NO5 MolecularWeight: 345.38962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(C2=CC=CO2)N3CCCC(C3)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(C2=CC=CO2)N3CCCC(C3)C(=O)O)OC

InChI

InChI=1S/C19H23NO5/c1-23-14-7-8-15(17(11-14)24-2)18(16-6-4-10-25-16)20-9-3-5-13(12-20)19(21)22/h4,6-8,10-11,13,18H,3,5,9,12H2,1-2H3,(H,21,22)