5-(4-ethylpiperazin-1-yl)sulfonyl-2-[(3S)-oxolan-3-yl]oxy-pyridine-3-carboxylic acid

Systemtic Name: 5-(4-ethylpiperazin-1-yl)sulfonyl-2-[(3S)-oxolan-3-yl]oxy-pyridine-3-carboxylic acid Openeye Name: 5-(4-ethylpiperazin-1-yl)sulfonyl-2-[(3S)-tetrahydrofuran-3-yl]oxy-pyridine-3-carboxylic acid CAS Name: 5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-[[(3S)-3-oxolanyl]oxy]-3-pyridinecarboxylic acid IUPAC Name: 5-(4-ethylpiperazin-1-yl)sulfonyl-2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxylic acid Traditional Name: 5-(4-ethylpiperazino)sulfonyl-2-[(3S)-tetrahydrofuran-3-yl]oxy-nicotinic acid Formula: C16H23N3O6S MolecularWeight: 385.43532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C(=O)O)OC3CCOC3

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C(=O)O)O[C@H]3CCOC3

InChI

InChI=1S/C16H23N3O6S/c1-2-18-4-6-19(7-5-18)26(22,23)13-9-14(16(20)21)15(17-10-13)25-12-3-8-24-11-12/h9-10,12H,2-8,11H2,1H3,(H,20,21)/t12-/m0/s1