3-oxidanyl-2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid

Systemtic Name: 3-oxidanyl-2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid Openeye Name: 3-hydroxy-2-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]butanoic acid CAS Name: 3-hydroxy-2-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid Traditional Name: 3-hydroxy-2-[[(E)-3-(3-pyridyl)acryloyl]amino]butyric acid Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C(C(=O)O)NC(=O)/C=C/C1=CN=CC=C1)O

InChI

InChI=1S/C12H14N2O4/c1-8(15)11(12(17)18)14-10(16)5-4-9-3-2-6-13-7-9/h2-8,11,15H,1H3,(H,14,16)(H,17,18)/b5-4+