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

Systemtic Name: 1-[(3-phenoxyphenyl)-thiophen-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-phenoxyphenyl)-(3-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-phenoxyphenyl)-(3-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-phenoxyphenyl)-thiophen-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-phenoxyphenyl)-(3-thienyl)methyl]pipecolinic acid Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C23H23NO3S/c25-23(26)21-11-4-5-13-24(21)22(18-12-14-28-16-18)17-7-6-10-20(15-17)27-19-8-2-1-3-9-19/h1-3,6-10,12,14-16,21-22H,4-5,11,13H2,(H,25,26)