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

Systemtic Name: 2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxylic acid Openeye Name: 2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxylic acid CAS Name: 2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinecarboxylic acid IUPAC Name: 2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylpyridine-3-carboxylic acid Traditional Name: 2-ethoxy-5-(4-ethylpiperazino)sulfonyl-nicotinic acid Formula: C14H21N3O5S MolecularWeight: 343.39864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O5S/c1-3-16-5-7-17(8-6-16)23(20,21)11-9-12(14(18)19)13(15-10-11)22-4-2/h9-10H,3-8H2,1-2H3,(H,18,19)