1-[(4-phenylphenyl)-thiophen-3-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-phenylphenyl)-thiophen-3-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-phenylphenyl)-(3-thienyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-phenylphenyl)-(3-thiophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-phenylphenyl)-thiophen-3-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-phenylphenyl)-(3-thienyl)methyl]isonipecotic acid Formula: C23H23NO2S MolecularWeight: 377.49922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C23H23NO2S/c25-23(26)20-10-13-24(14-11-20)22(21-12-15-27-16-21)19-8-6-18(7-9-19)17-4-2-1-3-5-17/h1-9,12,15-16,20,22H,10-11,13-14H2,(H,25,26)