1-[1-(3-ethoxyphenyl)pentyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[1-(3-ethoxyphenyl)pentyl]piperidine-3-carboxylic acid Openeye Name: 1-[1-(3-ethoxyphenyl)pentyl]piperidine-3-carboxylic acid CAS Name: 1-[1-(3-ethoxyphenyl)pentyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-ethoxyphenyl)pentyl]piperidine-3-carboxylic acid Traditional Name: 1-(1-m-phenetylpentyl)nipecotic acid Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO3/c1-3-5-11-18(15-8-6-10-17(13-15)23-4-2)20-12-7-9-16(14-20)19(21)22/h6,8,10,13,16,18H,3-5,7,9,11-12,14H2,1-2H3,(H,21,22)