1-[2-(3-ethylphenoxy)ethanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(3-ethylphenoxy)ethanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(3-ethylphenoxy)acetyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(3-ethylphenoxy)-1-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-ethylphenoxy)acetyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(3-ethylphenoxy)acetyl]nipecotic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)OCC(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-2-12-5-3-7-14(9-12)21-11-15(18)17-8-4-6-13(10-17)16(19)20/h3,5,7,9,13H,2,4,6,8,10-11H2,1H3,(H,19,20)