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

Systemtic Name: 1-[(4-butoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-butoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-butoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-butoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(4-butoxybenzyl)nipecotic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2CCCC(C2)C(=O)O

InChI

InChI=1S/C17H25NO3/c1-2-3-11-21-16-8-6-14(7-9-16)12-18-10-4-5-15(13-18)17(19)20/h6-9,15H,2-5,10-13H2,1H3,(H,19,20)