5-(4-ethylpiperazin-1-yl)sulfonyl-2-(oxan-4-yloxy)pyridine-3-carboxylic acid

Systemtic Name: 5-(4-ethylpiperazin-1-yl)sulfonyl-2-(oxan-4-yloxy)pyridine-3-carboxylic acid Openeye Name: 5-(4-ethylpiperazin-1-yl)sulfonyl-2-tetrahydropyran-4-yloxy-pyridine-3-carboxylic acid CAS Name: 5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-(4-oxanyloxy)-3-pyridinecarboxylic acid IUPAC Name: 5-(4-ethylpiperazin-1-yl)sulfonyl-2-(oxan-4-yloxy)pyridine-3-carboxylic acid Traditional Name: 5-(4-ethylpiperazino)sulfonyl-2-tetrahydropyran-4-yloxy-nicotinic acid Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C(=O)O)OC3CCOCC3

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C(=O)O)OC3CCOCC3

InChI

InChI=1S/C17H25N3O6S/c1-2-19-5-7-20(8-6-19)27(23,24)14-11-15(17(21)22)16(18-12-14)26-13-3-9-25-10-4-13/h11-13H,2-10H2,1H3,(H,21,22)