5-chloranyl-6-[[2-oxidanylidene-2-(propylamino)ethyl]amino]pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-[[2-oxidanylidene-2-(propylamino)ethyl]amino]pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-[[2-oxo-2-(propylamino)ethyl]amino]pyridine-3-carboxylic acid CAS Name: 5-chloro-6-[[2-oxo-2-(propylamino)ethyl]amino]-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-[[2-oxo-2-(propylamino)ethyl]amino]pyridine-3-carboxylic acid Traditional Name: 5-chloro-6-[[2-keto-2-(propylamino)ethyl]amino]nicotinic acid Formula: C11H14ClN3O3 MolecularWeight: 271.70016

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC1=C(C=C(C=N1)C(=O)O)Cl

Isomeric SMILES

CCCNC(=O)CNC1=C(C=C(C=N1)C(=O)O)Cl

InChI

InChI=1S/C11H14ClN3O3/c1-2-3-13-9(16)6-15-10-8(12)4-7(5-14-10)11(17)18/h4-5H,2-3,6H2,1H3,(H,13,16)(H,14,15)(H,17,18)