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

Systemtic Name: 4-[methyl-[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid Openeye Name: 4-[methyl-[(E)-3-(3-pyridyl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[methyl-[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]butanoic acid IUPAC Name: 4-[methyl-[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid Traditional Name: 4-[methyl-[(E)-3-(3-pyridyl)acryloyl]amino]butyric acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O3/c1-15(9-3-5-13(17)18)12(16)7-6-11-4-2-8-14-10-11/h2,4,6-8,10H,3,5,9H2,1H3,(H,17,18)/b7-6+