2-(4-methoxyphenyl)sulfonyl-1-[(4-phenylphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-1-[(4-phenylphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 2-(4-methoxyphenyl)sulfonyl-1-[(4-phenylphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 2-(4-methoxyphenyl)sulfonyl-1-[(4-phenylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 2-(4-methoxyphenyl)sulfonyl-1-[(4-phenylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 2-(4-methoxyphenyl)sulfonyl-1-(4-phenylbenzyl)isonipecotic acid Formula: C26H27NO5S MolecularWeight: 465.56128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2CC(CCN2CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2CC(CCN2CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H27NO5S/c1-32-23-11-13-24(14-12-23)33(30,31)25-17-22(26(28)29)15-16-27(25)18-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-14,22,25H,15-18H2,1H3,(H,28,29)