(E)-4-oxidanylidene-4-[prop-2-enyl(pyridin-4-ylmethyl)amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[prop-2-enyl(pyridin-4-ylmethyl)amino]but-2-enoic acid Openeye Name: (E)-4-[allyl(4-pyridylmethyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-[prop-2-enyl(pyridin-4-ylmethyl)amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[prop-2-enyl(pyridin-4-ylmethyl)amino]but-2-enoic acid Traditional Name: (E)-4-[allyl(4-pyridylmethyl)amino]-4-keto-but-2-enoic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=NC=C1)C(=O)C=CC(=O)O

Isomeric SMILES

C=CCN(CC1=CC=NC=C1)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H14N2O3/c1-2-9-15(12(16)3-4-13(17)18)10-11-5-7-14-8-6-11/h2-8H,1,9-10H2,(H,17,18)/b4-3+