1-(3-nitrophenyl)sulfonylpiperidine-3,5-dicarboxylic acid

Systemtic Name: 1-(3-nitrophenyl)sulfonylpiperidine-3,5-dicarboxylic acid Openeye Name: 1-(3-nitrophenyl)sulfonylpiperidine-3,5-dicarboxylic acid CAS Name: 1-(3-nitrophenyl)sulfonylpiperidine-3,5-dicarboxylic acid IUPAC Name: 1-(3-nitrophenyl)sulfonylpiperidine-3,5-dicarboxylic acid Traditional Name: 1-(3-nitrophenyl)sulfonylpiperidine-3,5-dicarboxylic acid Formula: C13H14N2O8S MolecularWeight: 358.32386

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1C(=O)O)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C(CN(CC1C(=O)O)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H14N2O8S/c16-12(17)8-4-9(13(18)19)7-14(6-8)24(22,23)11-3-1-2-10(5-11)15(20)21/h1-3,5,8-9H,4,6-7H2,(H,16,17)(H,18,19)