1-[1-(3-phenoxyphenyl)pentyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(3-phenoxyphenyl)pentyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(3-phenoxyphenyl)pentyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(3-phenoxyphenyl)pentyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-phenoxyphenyl)pentyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(3-phenoxyphenyl)pentyl]isonipecotic acid Formula: C23H29NO3 MolecularWeight: 367.48126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=CC=C1)OC2=CC=CC=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CCCCC(C1=CC(=CC=C1)OC2=CC=CC=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C23H29NO3/c1-2-3-12-22(24-15-13-18(14-16-24)23(25)26)19-8-7-11-21(17-19)27-20-9-5-4-6-10-20/h4-11,17-18,22H,2-3,12-16H2,1H3,(H,25,26)