4-[[5-(2,5-dimethylphenoxy)pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-(2,5-dimethylphenoxy)pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-(2,5-dimethylphenoxy)-2-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[5-(2,5-dimethylphenoxy)-2-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[5-(2,5-dimethylphenoxy)pyridin-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[5-(2,5-dimethylphenoxy)-2-pyridyl]amino]-4-keto-butyric acid Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CN=C(C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CN=C(C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C17H18N2O4/c1-11-3-4-12(2)14(9-11)23-13-5-6-15(18-10-13)19-16(20)7-8-17(21)22/h3-6,9-10H,7-8H2,1-2H3,(H,21,22)(H,18,19,20)