5-chloranyl-6-(3-methylbutylamino)pyridine-3-carboxylate

Systemtic Name: 5-chloranyl-6-(3-methylbutylamino)pyridine-3-carboxylate Openeye Name: 5-chloro-6-(isopentylamino)pyridine-3-carboxylate CAS Name: 5-chloro-6-(3-methylbutylamino)-3-pyridinecarboxylate IUPAC Name: 5-chloro-6-(3-methylbutylamino)pyridine-3-carboxylate Traditional Name: 5-chloro-6-(isoamylamino)nicotinate Formula: C11H14ClN2O2- MolecularWeight: 241.69406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C=C(C=N1)C(=O)[O-])Cl

Isomeric SMILES

CC(C)CCNC1=C(C=C(C=N1)C(=O)[O-])Cl

InChI

InChI=1S/C11H15ClN2O2/c1-7(2)3-4-13-10-9(12)5-8(6-14-10)11(15)16/h5-7H,3-4H2,1-2H3,(H,13,14)(H,15,16)/p-1