(E)-2-acetamido-3-(4-bromophenyl)pent-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(4-bromophenyl)pent-2-enoic acid Openeye Name: (E)-2-acetamido-3-(4-bromophenyl)pent-2-enoic acid CAS Name: (E)-2-acetamido-3-(4-bromophenyl)-2-pentenoic acid IUPAC Name: (E)-2-acetamido-3-(4-bromophenyl)pent-2-enoic acid Traditional Name: (E)-2-acetamido-3-(4-bromophenyl)pent-2-enoic acid Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrNO3/c1-3-11(9-4-6-10(14)7-5-9)12(13(17)18)15-8(2)16/h4-7H,3H2,1-2H3,(H,15,16)(H,17,18)/b12-11+