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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C=CC1=CN=CC=C1

Isomeric SMILES

COC(=O)CCCNC(=O)/C=C/C1=CN=CC=C1

InChI

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