2,2-diethyl-4-oxidanylidene-4-(pyridin-3-ylamino)butanoic acid

Systemtic Name: 2,2-diethyl-4-oxidanylidene-4-(pyridin-3-ylamino)butanoic acid Openeye Name: 2,2-diethyl-4-oxo-4-(3-pyridylamino)butanoic acid CAS Name: 2,2-diethyl-4-oxo-4-(3-pyridinylamino)butanoic acid IUPAC Name: 2,2-diethyl-4-oxo-4-(pyridin-3-ylamino)butanoic acid Traditional Name: 2,2-diethyl-4-keto-4-(3-pyridylamino)butyric acid Formula: C13H18N2O3 MolecularWeight: 250.29362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=CN=CC=C1)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=CN=CC=C1)C(=O)O

InChI

InChI=1S/C13H18N2O3/c1-3-13(4-2,12(17)18)8-11(16)15-10-6-5-7-14-9-10/h5-7,9H,3-4,8H2,1-2H3,(H,15,16)(H,17,18)