4-[2-[(5-nitropyridin-2-yl)amino]-1-oxidanyl-ethyl]phenol

Systemtic Name: 4-[2-[(5-nitropyridin-2-yl)amino]-1-oxidanyl-ethyl]phenol Openeye Name: 4-[1-hydroxy-2-[(5-nitro-2-pyridyl)amino]ethyl]phenol CAS Name: 4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol IUPAC Name: 4-[1-hydroxy-2-[(5-nitropyridin-2-yl)amino]ethyl]phenol Traditional Name: 4-[1-hydroxy-2-[(5-nitro-2-pyridyl)amino]ethyl]phenol Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O4/c17-11-4-1-9(2-5-11)12(18)8-15-13-6-3-10(7-14-13)16(19)20/h1-7,12,17-18H,8H2,(H,14,15)