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

Systemtic Name: 1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,3,4-trimethoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(2,3,4-trimethoxybenzyl)isonipecotic acid Formula: C16H23NO5 MolecularWeight: 309.35752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCC(CC2)C(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCC(CC2)C(=O)O)OC)OC

InChI

InChI=1S/C16H23NO5/c1-20-13-5-4-12(14(21-2)15(13)22-3)10-17-8-6-11(7-9-17)16(18)19/h4-5,11H,6-10H2,1-3H3,(H,18,19)