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

Systemtic Name: 1-[furan-2-yl-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-furyl-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[2-furanyl-(2,3,4-trimethoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[furan-2-yl-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-furyl-(2,3,4-trimethoxyphenyl)methyl]nipecotic acid Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO6/c1-24-16-9-8-14(18(25-2)19(16)26-3)17(15-7-5-11-27-15)21-10-4-6-13(12-21)20(22)23/h5,7-9,11,13,17H,4,6,10,12H2,1-3H3,(H,22,23)