1-[(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3,4,5-trimethoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(3,4,5-trimethoxybenzyl)isonipecotic acid Formula: C16H23NO5 MolecularWeight: 309.35752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CCC(CC2)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CCC(CC2)C(=O)O

InChI

InChI=1S/C16H23NO5/c1-20-13-8-11(9-14(21-2)15(13)22-3)10-17-6-4-12(5-7-17)16(18)19/h8-9,12H,4-7,10H2,1-3H3,(H,18,19)