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

Systemtic Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[(E)-3-(4-cyanophenyl)acryloyl]amino]-3-hydroxy-propionic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC(CO)C(=O)O)C#N

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O4/c14-7-10-3-1-9(2-4-10)5-6-12(17)15-11(8-16)13(18)19/h1-6,11,16H,8H2,(H,15,17)(H,18,19)/b6-5+