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

Systemtic Name: 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]propanoic acid Openeye Name: 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]propanoic acid CAS Name: 2-[[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]propanoic acid Traditional Name: 2-[[(E)-3-(4-bromophenyl)acryloyl]amino]propionic acid Formula: C12H12BrNO3 MolecularWeight: 298.13258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C=CC1=CC=C(C=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrNO3/c1-8(12(16)17)14-11(15)7-4-9-2-5-10(13)6-3-9/h2-8H,1H3,(H,14,15)(H,16,17)/b7-4+