(2R)-4-(4-bromophenyl)-2-(2-hydroxyethylazaniumyl)-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-(4-bromophenyl)-2-(2-hydroxyethylazaniumyl)-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-bromophenyl)-2-(2-hydroxyethylammonio)-4-oxo-butanoate CAS Name: (2R)-4-(4-bromophenyl)-2-(2-hydroxyethylammonio)-4-oxobutanoate IUPAC Name: (2R)-4-(4-bromophenyl)-2-(2-hydroxyethylazaniumyl)-4-oxobutanoate Traditional Name: (2R)-4-(4-bromophenyl)-2-(2-hydroxyethylammonio)-4-keto-butyrate Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CC(C(=O)[O-])[NH2+]CCO)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)C[C@H](C(=O)[O-])[NH2+]CCO)Br

InChI

InChI=1S/C12H14BrNO4/c13-9-3-1-8(2-4-9)11(16)7-10(12(17)18)14-5-6-15/h1-4,10,14-15H,5-7H2,(H,17,18)/t10-/m1/s1