(2S,3S)-2-[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2S,3S)-2-[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]-3-oxidanyl-butanoate Openeye Name: (2S,3S)-2-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3-hydroxy-butanoate CAS Name: (2S,3S)-2-[[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]amino]-3-hydroxybutanoate IUPAC Name: (2S,3S)-2-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3-hydroxybutanoate Traditional Name: (2S,3S)-2-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3-hydroxy-butyrate Formula: C9H10BrN2O4- MolecularWeight: 290.0907

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)C1=CC(=CN1)Br)O

Isomeric SMILES

C[C@@H]([C@@H](C(=O)[O-])NC(=O)C1=CC(=CN1)Br)O

InChI

InChI=1S/C9H11BrN2O4/c1-4(13)7(9(15)16)12-8(14)6-2-5(10)3-11-6/h2-4,7,11,13H,1H3,(H,12,14)(H,15,16)/p-1/t4-,7-/m0/s1