(1S)-1-(4-nitrophenyl)-2-[(5-nitropyridin-2-yl)amino]ethanol

Systemtic Name: (1S)-1-(4-nitrophenyl)-2-[(5-nitropyridin-2-yl)amino]ethanol Openeye Name: (1S)-1-(4-nitrophenyl)-2-[(5-nitro-2-pyridyl)amino]ethanol CAS Name: (1S)-1-(4-nitrophenyl)-2-[(5-nitro-2-pyridinyl)amino]ethanol IUPAC Name: (1S)-1-(4-nitrophenyl)-2-[(5-nitropyridin-2-yl)amino]ethanol Traditional Name: (1S)-1-(4-nitrophenyl)-2-[(5-nitro-2-pyridyl)amino]ethanol Formula: C13H12N4O5 MolecularWeight: 304.25818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CNC2=NC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[C@@H](CNC2=NC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O5/c18-12(9-1-3-10(4-2-9)16(19)20)8-15-13-6-5-11(7-14-13)17(21)22/h1-7,12,18H,8H2,(H,14,15)/t12-/m1/s1