1-(4-ethoxycarbonylpiperazin-1-yl)sulfonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(4-ethoxycarbonylpiperazin-1-yl)sulfonylpiperidine-3-carboxylic acid Openeye Name: 1-(4-ethoxycarbonylpiperazin-1-yl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-[(4-ethoxycarbonyl-1-piperazinyl)sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(4-ethoxycarbonylpiperazin-1-yl)sulfonylpiperidine-3-carboxylic acid Traditional Name: 1-(4-carbethoxypiperazino)sulfonylnipecotic acid Formula: C13H23N3O6S MolecularWeight: 349.40322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C13H23N3O6S/c1-2-22-13(19)14-6-8-15(9-7-14)23(20,21)16-5-3-4-11(10-16)12(17)18/h11H,2-10H2,1H3,(H,17,18)