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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C2=CC=CO2)N3CCCC(C3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)C(C2=CC=CO2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C19H23NO5/c1-23-16-8-3-7-14(18(16)24-2)17(15-9-5-11-25-15)20-10-4-6-13(12-20)19(21)22/h3,5,7-9,11,13,17H,4,6,10,12H2,1-2H3,(H,21,22)