3-chloranyl-6-[[(2S)-5-(diethylazaniumyl)pentan-2-yl]amino]pyridine-2-carboxylate

Systemtic Name: 3-chloranyl-6-[[(2S)-5-(diethylazaniumyl)pentan-2-yl]amino]pyridine-2-carboxylate Openeye Name: 3-chloro-6-[[(1S)-4-(diethylammonio)-1-methyl-butyl]amino]pyridine-2-carboxylate CAS Name: 3-chloro-6-[[(2S)-5-(diethylammonio)pentan-2-yl]amino]-2-pyridinecarboxylate IUPAC Name: 3-chloro-6-[[(2S)-5-(diethylazaniumyl)pentan-2-yl]amino]pyridine-2-carboxylate Traditional Name: 3-chloro-6-[[(1S)-4-(diethylammonio)-1-methyl-butyl]amino]picolinate Formula: C15H24ClN3O2 MolecularWeight: 313.82296

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC1=NC(=C(C=C1)Cl)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC1=NC(=C(C=C1)Cl)C(=O)[O-]

InChI

InChI=1S/C15H24ClN3O2/c1-4-19(5-2)10-6-7-11(3)17-13-9-8-12(16)14(18-13)15(20)21/h8-9,11H,4-7,10H2,1-3H3,(H,17,18)(H,20,21)/t11-/m0/s1