4-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[6-(2,5-dimethylphenoxy)-3-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[6-(2,5-dimethylphenoxy)-3-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[6-(2,5-dimethylphenoxy)-3-pyridyl]amino]-4-keto-butyric acid Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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