2-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]pyridine-3-carboxylic acid Openeye Name: 2-[[2-(isopropylamino)-2-oxo-ethyl]amino]pyridine-3-carboxylic acid CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-3-pyridinecarboxylic acid IUPAC Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]pyridine-3-carboxylic acid Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]amino]nicotinic acid Formula: C11H15N3O3 MolecularWeight: 237.2551

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC1=C(C=CC=N1)C(=O)O

Isomeric SMILES

CC(C)NC(=O)CNC1=C(C=CC=N1)C(=O)O

InChI

InChI=1S/C11H15N3O3/c1-7(2)14-9(15)6-13-10-8(11(16)17)4-3-5-12-10/h3-5,7H,6H2,1-2H3,(H,12,13)(H,14,15)(H,16,17)