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

Systemtic Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]pentanoic acid Openeye Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]pentanoic acid CAS Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)-1-oxoprop-2-enyl]amino]pentanoic acid IUPAC Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]pentanoic acid Traditional Name: 2-[[(E)-3-(1,3-benzoxazol-2-yl)acryloyl]amino]valeric acid Formula: C15H16N2O4 MolecularWeight: 288.29854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O4/c1-2-5-11(15(19)20)16-13(18)8-9-14-17-10-6-3-4-7-12(10)21-14/h3-4,6-9,11H,2,5H2,1H3,(H,16,18)(H,19,20)/b9-8+