1-[1-(3-methoxy-4-phenylmethoxy-phenyl)pentyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(3-methoxy-4-phenylmethoxy-phenyl)pentyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(4-benzyloxy-3-methoxy-phenyl)pentyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(3-methoxy-4-phenylmethoxyphenyl)pentyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-methoxy-4-phenylmethoxyphenyl)pentyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(4-benzoxy-3-methoxy-phenyl)pentyl]isonipecotic acid Formula: C25H33NO4 MolecularWeight: 411.53382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)N3CCC(CC3)C(=O)O

Isomeric SMILES

CCCCC(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C25H33NO4/c1-3-4-10-22(26-15-13-20(14-16-26)25(27)28)21-11-12-23(24(17-21)29-2)30-18-19-8-6-5-7-9-19/h5-9,11-12,17,20,22H,3-4,10,13-16,18H2,1-2H3,(H,27,28)