(2S)-4-azanyl-2-[2-(4-bromophenyl)ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-4-azanyl-2-[2-(4-bromophenyl)ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: (2S)-4-amino-2-[[2-(4-bromophenyl)acetyl]amino]-4-oxo-butanoic acid CAS Name: (2S)-4-amino-2-[[2-(4-bromophenyl)-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: (2S)-4-amino-2-[[2-(4-bromophenyl)acetyl]amino]-4-oxobutanoic acid Traditional Name: (2S)-4-amino-2-[[2-(4-bromophenyl)acetyl]amino]-4-keto-butyric acid Formula: C12H13BrN2O4 MolecularWeight: 329.14662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC(CC(=O)N)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1CC(=O)N[C@@H](CC(=O)N)C(=O)O)Br

InChI

InChI=1S/C12H13BrN2O4/c13-8-3-1-7(2-4-8)5-11(17)15-9(12(18)19)6-10(14)16/h1-4,9H,5-6H2,(H2,14,16)(H,15,17)(H,18,19)/t9-/m0/s1