1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-(4-nitrophenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-nosylisonipecotic acid Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O6S/c15-12(16)9-5-7-13(8-6-9)21(19,20)11-3-1-10(2-4-11)14(17)18/h1-4,9H,5-8H2,(H,15,16)