(E)-4-[4-azanyl-3,5-bis(bromanyl)phenyl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[4-azanyl-3,5-bis(bromanyl)phenyl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(4-amino-3,5-dibromo-phenyl)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(4-amino-3,5-dibromophenyl)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(4-amino-3,5-dibromophenyl)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(4-amino-3,5-dibromo-phenyl)-4-keto-but-2-enoic acid Formula: C10H7Br2NO3 MolecularWeight: 348.97548

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)N)Br)C(=O)C=CC(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1Br)N)Br)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C10H7Br2NO3/c11-6-3-5(4-7(12)10(6)13)8(14)1-2-9(15)16/h1-4H,13H2,(H,15,16)/b2-1+