2-[[4-(4-bromophenyl)-4-oxidanylidene-butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[4-(4-bromophenyl)-4-oxidanylidene-butanoyl]amino]ethanoic acid Openeye Name: 2-[[4-(4-bromophenyl)-4-oxo-butanoyl]amino]acetic acid CAS Name: 2-[[4-(4-bromophenyl)-1,4-dioxobutyl]amino]acetic acid IUPAC Name: 2-[[4-(4-bromophenyl)-4-oxobutanoyl]amino]acetic acid Traditional Name: 2-[[4-(4-bromophenyl)-4-keto-butanoyl]amino]acetic acid Formula: C12H12BrNO4 MolecularWeight: 314.13198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCC(=O)NCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCC(=O)NCC(=O)O)Br

InChI

InChI=1S/C12H12BrNO4/c13-9-3-1-8(2-4-9)10(15)5-6-11(16)14-7-12(17)18/h1-4H,5-7H2,(H,14,16)(H,17,18)