1-[(4-propoxyphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-propoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-propoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-propoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-propoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(4-propoxybenzyl)nipecotic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)CN2CCCC(C2)C(=O)O

InChI

InChI=1S/C16H23NO3/c1-2-10-20-15-7-5-13(6-8-15)11-17-9-3-4-14(12-17)16(18)19/h5-8,14H,2-4,9-12H2,1H3,(H,18,19)