1-[(3-methylthiophen-2-yl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-methylthiophen-2-yl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-methyl-2-thienyl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-methyl-2-thiophenyl)-(4-phenylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-methylthiophen-2-yl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-methyl-2-thienyl)-(4-phenylphenyl)methyl]isonipecotic acid Formula: C24H25NO2S MolecularWeight: 391.5258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C24H25NO2S/c1-17-13-16-28-23(17)22(25-14-11-21(12-15-25)24(26)27)20-9-7-19(8-10-20)18-5-3-2-4-6-18/h2-10,13,16,21-22H,11-12,14-15H2,1H3,(H,26,27)