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

Systemtic Name: 6-[[(2S)-butan-2-yl]amino]-5-chloranyl-pyridine-3-carboxylate Openeye Name: 5-chloro-6-[[(1S)-1-methylpropyl]amino]pyridine-3-carboxylate CAS Name: 6-[[(2S)-butan-2-yl]amino]-5-chloro-3-pyridinecarboxylate IUPAC Name: 6-[[(2S)-butan-2-yl]amino]-5-chloropyridine-3-carboxylate Traditional Name: 5-chloro-6-[[(1S)-1-methylpropyl]amino]nicotinate Formula: C10H12ClN2O2- MolecularWeight: 227.66748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C=C(C=N1)C(=O)[O-])Cl

Isomeric SMILES

CC[C@H](C)NC1=C(C=C(C=N1)C(=O)[O-])Cl

InChI

InChI=1S/C10H13ClN2O2/c1-3-6(2)13-9-8(11)4-7(5-12-9)10(14)15/h4-6H,3H2,1-2H3,(H,12,13)(H,14,15)/p-1/t6-/m0/s1