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

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-1-[(4-thiophen-2-ylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 4-(4-methoxyphenyl)sulfonyl-1-[[4-(2-thienyl)phenyl]methyl]piperidine-2-carboxylic acid CAS Name: 4-(4-methoxyphenyl)sulfonyl-1-[(4-thiophen-2-ylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 4-(4-methoxyphenyl)sulfonyl-1-[(4-thiophen-2-ylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 4-(4-methoxyphenyl)sulfonyl-1-[4-(2-thienyl)benzyl]pipecolinic acid Formula: C24H25NO5S2 MolecularWeight: 471.589

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2CCN(C(C2)C(=O)O)CC3=CC=C(C=C3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2CCN(C(C2)C(=O)O)CC3=CC=C(C=C3)C4=CC=CS4

InChI

InChI=1S/C24H25NO5S2/c1-30-19-8-10-20(11-9-19)32(28,29)21-12-13-25(22(15-21)24(26)27)16-17-4-6-18(7-5-17)23-3-2-14-31-23/h2-11,14,21-22H,12-13,15-16H2,1H3,(H,26,27)