methyl N-[(2S)-1-(2-nitro-4-oxidanyl-phenyl)-3-oxidanyl-propan-2-yl]carbamate

Systemtic Name: methyl N-[(2S)-1-(2-nitro-4-oxidanyl-phenyl)-3-oxidanyl-propan-2-yl]carbamate Openeye Name: methyl N-[(1S)-1-(hydroxymethyl)-2-(4-hydroxy-2-nitro-phenyl)ethyl]carbamate CAS Name: N-[(2S)-1-hydroxy-3-(4-hydroxy-2-nitrophenyl)propan-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[(2S)-1-hydroxy-3-(4-hydroxy-2-nitrophenyl)propan-2-yl]carbamate Traditional Name: N-[(1S)-2-hydroxy-1-(4-hydroxy-2-nitro-benzyl)ethyl]carbamic acid methyl ester Formula: C11H14N2O6 MolecularWeight: 270.23866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CC1=C(C=C(C=C1)O)[N+](=O)[O-])CO

Isomeric SMILES

COC(=O)N[C@@H](CC1=C(C=C(C=C1)O)[N+](=O)[O-])CO

InChI

InChI=1S/C11H14N2O6/c1-19-11(16)12-8(6-14)4-7-2-3-9(15)5-10(7)13(17)18/h2-3,5,8,14-15H,4,6H2,1H3,(H,12,16)/t8-/m0/s1