(E)-5-(2-bromophenyl)-2-methoxycarbonyl-pent-4-enoic acid

Systemtic Name: (E)-5-(2-bromophenyl)-2-methoxycarbonyl-pent-4-enoic acid Openeye Name: (E)-5-(2-bromophenyl)-2-methoxycarbonyl-pent-4-enoic acid CAS Name: (E)-5-(2-bromophenyl)-2-methoxycarbonyl-4-pentenoic acid IUPAC Name: (E)-5-(2-bromophenyl)-2-methoxycarbonylpent-4-enoic acid Traditional Name: (E)-5-(2-bromophenyl)-2-carbomethoxy-pent-4-enoic acid Formula: C13H13BrO4 MolecularWeight: 313.14392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC=CC1=CC=CC=C1Br)C(=O)O

Isomeric SMILES

COC(=O)C(C/C=C/C1=CC=CC=C1Br)C(=O)O

InChI

InChI=1S/C13H13BrO4/c1-18-13(17)10(12(15)16)7-4-6-9-5-2-3-8-11(9)14/h2-6,8,10H,7H2,1H3,(H,15,16)/b6-4+