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

Systemtic Name: 4-(oxidanylcarbamoyl)-4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1-carboxylic acid Openeye Name: 4-(hydroxycarbamoyl)-4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1-carboxylic acid CAS Name: 4-[(hydroxyamino)-oxomethyl]-4-[(4-phenoxyphenyl)sulfonylmethyl]-1-piperidinecarboxylic acid IUPAC Name: 4-(hydroxycarbamoyl)-4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1-carboxylic acid Traditional Name: 4-(hydroxycarbamoyl)-4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1-carboxylic acid Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O7S/c23-18(21-26)20(10-12-22(13-11-20)19(24)25)14-30(27,28)17-8-6-16(7-9-17)29-15-4-2-1-3-5-15/h1-9,26H,10-14H2,(H,21,23)(H,24,25)