(2S)-5-azanyl-2-[2-(4-bromophenyl)ethanoylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (2S)-5-azanyl-2-[2-(4-bromophenyl)ethanoylamino]-5-oxidanylidene-pentanoate Openeye Name: (2S)-5-amino-2-[[2-(4-bromophenyl)acetyl]amino]-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-[[2-(4-bromophenyl)-1-oxoethyl]amino]-5-oxopentanoate IUPAC Name: (2S)-5-amino-2-[[2-(4-bromophenyl)acetyl]amino]-5-oxopentanoate Traditional Name: (2S)-5-amino-2-[[2-(4-bromophenyl)acetyl]amino]-5-keto-valerate Formula: C13H14BrN2O4- MolecularWeight: 342.16526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC(CCC(=O)N)C(=O)[O-])Br

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN2O4/c14-9-3-1-8(2-4-9)7-12(18)16-10(13(19)20)5-6-11(15)17/h1-4,10H,5-7H2,(H2,15,17)(H,16,18)(H,19,20)/p-1/t10-/m0/s1