2-chloranyl-4-(cyclopropylamino)-1-(3-methoxy-3-oxidanylidene-propyl)-2H-pyridine-5-carboxylic acid

Systemtic Name: 2-chloranyl-4-(cyclopropylamino)-1-(3-methoxy-3-oxidanylidene-propyl)-2H-pyridine-5-carboxylic acid Openeye Name: 2-chloro-4-(cyclopropylamino)-1-(3-methoxy-3-oxo-propyl)-2H-pyridine-5-carboxylic acid CAS Name: 2-chloro-4-(cyclopropylamino)-1-(3-methoxy-3-oxopropyl)-2H-pyridine-5-carboxylic acid IUPAC Name: 2-chloro-4-(cyclopropylamino)-1-(3-methoxy-3-oxopropyl)-2H-pyridine-5-carboxylic acid Traditional Name: 2-chloro-4-(cyclopropylamino)-1-(3-keto-3-methoxy-propyl)-2H-pyridine-5-carboxylic acid Formula: C13H17ClN2O4 MolecularWeight: 300.73808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C=C(C(=CC1Cl)NC2CC2)C(=O)O

Isomeric SMILES

COC(=O)CCN1C=C(C(=CC1Cl)NC2CC2)C(=O)O

InChI

InChI=1S/C13H17ClN2O4/c1-20-12(17)4-5-16-7-9(13(18)19)10(6-11(16)14)15-8-2-3-8/h6-8,11,15H,2-5H2,1H3,(H,18,19)