2-[2-[[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethoxy]ethanol

Systemtic Name: 2-[2-[[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethoxy]ethanol Openeye Name: 2-[2-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]ethoxy]ethanol CAS Name: 2-[2-[[2-(4-chloroanilino)-5-nitro-4-pyrimidinyl]amino]ethoxy]ethanol IUPAC Name: 2-[2-[[2-(4-chloroanilino)-5-nitropyrimidin-4-yl]amino]ethoxy]ethanol Traditional Name: 2-[2-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]ethoxy]ethanol Formula: C14H16ClN5O4 MolecularWeight: 353.76094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=C(C(=N2)NCCOCCO)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=C(C(=N2)NCCOCCO)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H16ClN5O4/c15-10-1-3-11(4-2-10)18-14-17-9-12(20(22)23)13(19-14)16-5-7-24-8-6-21/h1-4,9,21H,5-8H2,(H2,16,17,18,19)