4-(4-bromanyl-3-phenacyl-phenyl)-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-(4-bromanyl-3-phenacyl-phenyl)-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-(4-bromo-3-phenacyl-phenyl)-2,4-dioxo-butanoic acid CAS Name: 4-(4-bromo-3-phenacylphenyl)-2,4-dioxobutanoic acid IUPAC Name: 4-(4-bromo-3-phenacylphenyl)-2,4-dioxobutanoic acid Traditional Name: 4-(4-bromo-3-phenacyl-phenyl)-2,4-diketo-butyric acid Formula: C18H13BrO5 MolecularWeight: 389.19682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC2=C(C=CC(=C2)C(=O)CC(=O)C(=O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC2=C(C=CC(=C2)C(=O)CC(=O)C(=O)O)Br

InChI

InChI=1S/C18H13BrO5/c19-14-7-6-12(16(21)10-17(22)18(23)24)8-13(14)9-15(20)11-4-2-1-3-5-11/h1-8H,9-10H2,(H,23,24)