(E)-5-[[6-(4-methoxyphenoxy)pyridin-3-yl]methylamino]-5-oxidanylidene-pent-2-enoic acid

Systemtic Name: (E)-5-[[6-(4-methoxyphenoxy)pyridin-3-yl]methylamino]-5-oxidanylidene-pent-2-enoic acid Openeye Name: (E)-5-[[6-(4-methoxyphenoxy)-3-pyridyl]methylamino]-5-oxo-pent-2-enoic acid CAS Name: (E)-5-[[6-(4-methoxyphenoxy)-3-pyridinyl]methylamino]-5-oxo-2-pentenoic acid IUPAC Name: (E)-5-[[6-(4-methoxyphenoxy)pyridin-3-yl]methylamino]-5-oxopent-2-enoic acid Traditional Name: (E)-5-keto-5-[[6-(4-methoxyphenoxy)-3-pyridyl]methylamino]pent-2-enoic acid Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=NC=C(C=C2)CNC(=O)CC=CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)OC2=NC=C(C=C2)CNC(=O)C/C=C/C(=O)O

InChI

InChI=1S/C18H18N2O5/c1-24-14-6-8-15(9-7-14)25-17-10-5-13(12-20-17)11-19-16(21)3-2-4-18(22)23/h2,4-10,12H,3,11H2,1H3,(H,19,21)(H,22,23)/b4-2+