6-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]amino]pyridine-3-carboxylic acid Openeye Name: 6-[[2-(cyclopropylamino)-2-oxo-ethyl]amino]pyridine-3-carboxylic acid CAS Name: 6-[[2-(cyclopropylamino)-2-oxoethyl]amino]-3-pyridinecarboxylic acid IUPAC Name: 6-[[2-(cyclopropylamino)-2-oxoethyl]amino]pyridine-3-carboxylic acid Traditional Name: 6-[[2-(cyclopropylamino)-2-keto-ethyl]amino]nicotinic acid Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CNC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

C1CC1NC(=O)CNC2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C11H13N3O3/c15-10(14-8-2-3-8)6-13-9-4-1-7(5-12-9)11(16)17/h1,4-5,8H,2-3,6H2,(H,12,13)(H,14,15)(H,16,17)