(2S,3S)-2-[(2-nitrophenyl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: (2S,3S)-2-[(2-nitrophenyl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: (2S,3S)-3-hydroxy-2-[(2-nitrobenzoyl)amino]butanoic acid CAS Name: (2S,3S)-3-hydroxy-2-[[(2-nitrophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: (2S,3S)-3-hydroxy-2-[(2-nitrobenzoyl)amino]butanoic acid Traditional Name: (2S,3S)-3-hydroxy-2-[(2-nitrobenzoyl)amino]butyric acid Formula: C11H12N2O6 MolecularWeight: 268.22278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=CC=CC=C1[N+](=O)[O-])O

Isomeric SMILES

C[C@@H]([C@@H](C(=O)O)NC(=O)C1=CC=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C11H12N2O6/c1-6(14)9(11(16)17)12-10(15)7-4-2-3-5-8(7)13(18)19/h2-6,9,14H,1H3,(H,12,15)(H,16,17)/t6-,9-/m0/s1