4-[furan-2-ylmethyl(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[furan-2-ylmethyl(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-furylmethyl(4-pyridylmethyl)amino]-4-oxo-butanoic acid CAS Name: 4-[2-furanylmethyl(pyridin-4-ylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[furan-2-ylmethyl(pyridin-4-ylmethyl)amino]-4-oxobutanoic acid Traditional Name: 4-[2-furfuryl(4-pyridylmethyl)amino]-4-keto-butyric acid Formula: C15H16N2O4 MolecularWeight: 288.29854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(CC2=CC=NC=C2)C(=O)CCC(=O)O

Isomeric SMILES

C1=COC(=C1)CN(CC2=CC=NC=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C15H16N2O4/c18-14(3-4-15(19)20)17(11-13-2-1-9-21-13)10-12-5-7-16-8-6-12/h1-2,5-9H,3-4,10-11H2,(H,19,20)