2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 2-[[(E)-3-(3-cyanophenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 2-[[(E)-3-(3-cyanophenyl)acryloyl]amino]butyric acid Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C=CC1=CC=CC(=C1)C#N

Isomeric SMILES

CCC(C(=O)O)NC(=O)/C=C/C1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H14N2O3/c1-2-12(14(18)19)16-13(17)7-6-10-4-3-5-11(8-10)9-15/h3-8,12H,2H2,1H3,(H,16,17)(H,18,19)/b7-6+