4-(oxidanylcarbamoyl)-4-[2-(4-phenoxyphenyl)sulfonylethyl]piperidine-1-carboxylic acid

Systemtic Name: 4-(oxidanylcarbamoyl)-4-[2-(4-phenoxyphenyl)sulfonylethyl]piperidine-1-carboxylic acid Openeye Name: 4-(hydroxycarbamoyl)-4-[2-(4-phenoxyphenyl)sulfonylethyl]piperidine-1-carboxylic acid CAS Name: 4-[(hydroxyamino)-oxomethyl]-4-[2-(4-phenoxyphenyl)sulfonylethyl]-1-piperidinecarboxylic acid IUPAC Name: 4-(hydroxycarbamoyl)-4-[2-(4-phenoxyphenyl)sulfonylethyl]piperidine-1-carboxylic acid Traditional Name: 4-(hydroxycarbamoyl)-4-[2-(4-phenoxyphenyl)sulfonylethyl]piperidine-1-carboxylic acid Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CCS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NO)C(=O)O

Isomeric SMILES

C1CN(CCC1(CCS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NO)C(=O)O

InChI

InChI=1S/C21H24N2O7S/c24-19(22-27)21(10-13-23(14-11-21)20(25)26)12-15-31(28,29)18-8-6-17(7-9-18)30-16-4-2-1-3-5-16/h1-9,27H,10-15H2,(H,22,24)(H,25,26)