1-[(3-phenylmethoxyphenyl)-thiophen-2-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-phenylmethoxyphenyl)-thiophen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-benzyloxyphenyl)-(2-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-phenylmethoxyphenyl)-thiophen-2-ylmethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-phenylmethoxyphenyl)-thiophen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-benzoxyphenyl)-(2-thienyl)methyl]pipecolinic acid Formula: C24H25NO3S MolecularWeight: 407.5252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C24H25NO3S/c26-24(27)21-12-4-5-14-25(21)23(22-13-7-15-29-22)19-10-6-11-20(16-19)28-17-18-8-2-1-3-9-18/h1-3,6-11,13,15-16,21,23H,4-5,12,14,17H2,(H,26,27)