2-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]propanoic acid

Systemtic Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]propanoic acid Openeye Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]propanoic acid CAS Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]propanoic acid Traditional Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)acryloyl]amino]propionic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C=CC1=NC2=CC=CC=C2O1

Isomeric SMILES

CC(C(=O)O)NC(=O)/C=C/C1=NC2=CC=CC=C2O1

InChI

InChI=1S/C13H12N2O4/c1-8(13(17)18)14-11(16)6-7-12-15-9-4-2-3-5-10(9)19-12/h2-8H,1H3,(H,14,16)(H,17,18)/b7-6+