3-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 3-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 3-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 3-[[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 3-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 3-[[(E)-3-(4-cyanophenyl)acryloyl]amino]butyric acid Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O3/c1-10(8-14(18)19)16-13(17)7-6-11-2-4-12(9-15)5-3-11/h2-7,10H,8H2,1H3,(H,16,17)(H,18,19)/b7-6+