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

Systemtic Name: 1-[(3,4-diethoxyphenyl)-(furan-2-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,4-diethoxyphenyl)-(2-furyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,4-diethoxyphenyl)-(2-furanyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-diethoxyphenyl)-(furan-2-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,4-diethoxyphenyl)-(2-furyl)methyl]pipecolinic acid Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC=CO2)N3CCCCC3C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=CO2)N3CCCCC3C(=O)O)OCC

InChI

InChI=1S/C21H27NO5/c1-3-25-17-11-10-15(14-19(17)26-4-2)20(18-9-7-13-27-18)22-12-6-5-8-16(22)21(23)24/h7,9-11,13-14,16,20H,3-6,8,12H2,1-2H3,(H,23,24)