5-azanyl-4-(butylamino)-6-(ethylamino)-2-methyl-pyridine-3-carboxylic acid

Systemtic Name: 5-azanyl-4-(butylamino)-6-(ethylamino)-2-methyl-pyridine-3-carboxylic acid Openeye Name: 5-amino-4-(butylamino)-6-(ethylamino)-2-methyl-pyridine-3-carboxylic acid CAS Name: 5-amino-4-(butylamino)-6-(ethylamino)-2-methyl-3-pyridinecarboxylic acid IUPAC Name: 5-amino-4-(butylamino)-6-(ethylamino)-2-methylpyridine-3-carboxylic acid Traditional Name: 5-amino-4-(butylamino)-6-(ethylamino)-2-methyl-nicotinic acid Formula: C13H22N4O2 MolecularWeight: 266.33938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC(=C1N)NCC)C)C(=O)O

Isomeric SMILES

CCCCNC1=C(C(=NC(=C1N)NCC)C)C(=O)O

InChI

InChI=1S/C13H22N4O2/c1-4-6-7-16-11-9(13(18)19)8(3)17-12(10(11)14)15-5-2/h4-7,14H2,1-3H3,(H,18,19)(H2,15,16,17)