1-[[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]amino]propan-2-ol

Systemtic Name: 1-[[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]amino]propan-2-ol Openeye Name: 1-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]propan-2-ol CAS Name: 1-[[2-(4-chloroanilino)-5-nitro-4-pyrimidinyl]amino]-2-propanol IUPAC Name: 1-[[2-(4-chloroanilino)-5-nitropyrimidin-4-yl]amino]propan-2-ol Traditional Name: 1-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]propan-2-ol Formula: C13H14ClN5O3 MolecularWeight: 323.73496

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC(CNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C13H14ClN5O3/c1-8(20)6-15-12-11(19(21)22)7-16-13(18-12)17-10-4-2-9(14)3-5-10/h2-5,7-8,20H,6H2,1H3,(H2,15,16,17,18)