6-[butan-2-yl(ethyl)amino]-5-chloranyl-pyridine-3-carboxylic acid

Systemtic Name: 6-[butan-2-yl(ethyl)amino]-5-chloranyl-pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-[ethyl(sec-butyl)amino]pyridine-3-carboxylic acid CAS Name: 6-[butan-2-yl(ethyl)amino]-5-chloro-3-pyridinecarboxylic acid IUPAC Name: 6-[butan-2-yl(ethyl)amino]-5-chloropyridine-3-carboxylic acid Traditional Name: 5-chloro-6-[ethyl(sec-butyl)amino]nicotinic acid Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC)C1=C(C=C(C=N1)C(=O)O)Cl

Isomeric SMILES

CCC(C)N(CC)C1=C(C=C(C=N1)C(=O)O)Cl

InChI

InChI=1S/C12H17ClN2O2/c1-4-8(3)15(5-2)11-10(13)6-9(7-14-11)12(16)17/h6-8H,4-5H2,1-3H3,(H,16,17)