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1-[(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid

1-[(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name:1-[(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid
Openeye Name:1-[(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid
CAS Name:1-[(2,4,5-trimethoxyphenyl)methyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid
Traditional Name:1-(2,4,5-trimethoxybenzyl)nipecotic acid
Formula: C16H23NO5
MolecularWeight: 309.35752
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CN2CCCC(C2)C(=O)O)OC)OC


Isomeric SMILES

COC1=CC(=C(C=C1CN2CCCC(C2)C(=O)O)OC)OC


InChI

InChI=1S/C16H23NO5/c1-20-13-8-15(22-3)14(21-2)7-12(13)10-17-6-4-5-11(9-17)16(18)19/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,19)


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