2-[2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[(E)-3-(4-bromophenyl)acryloyl]amino]acetyl]amino]acetic acid Formula: C13H13BrN2O4 MolecularWeight: 341.15732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NCC(=O)NCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NCC(=O)NCC(=O)O)Br

InChI

InChI=1S/C13H13BrN2O4/c14-10-4-1-9(2-5-10)3-6-11(17)15-7-12(18)16-8-13(19)20/h1-6H,7-8H2,(H,15,17)(H,16,18)(H,19,20)/b6-3+