2-chloranyl-6-(4,6-dimethoxypyrimidin-2-yl)oxy-benzoate; propan-2-ylazanium

Systemtic Name: 2-chloranyl-6-(4,6-dimethoxypyrimidin-2-yl)oxy-benzoate; propan-2-ylazanium Openeye Name: 2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)oxy-benzoate; isopropylammonium CAS Name: 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)oxy]benzoate; propan-2-ylammonium IUPAC Name: 2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoate; propan-2-ylazanium Traditional Name: 2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)oxy-benzoate; isopropylammonium Formula: C16H20ClN3O5 MolecularWeight: 369.8001

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH3+].COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)Cl)C(=O)[O-])OC

Isomeric SMILES

CC(C)[NH3+].COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)Cl)C(=O)[O-])OC

InChI

InChI=1S/C13H11ClN2O5.C3H9N/c1-19-9-6-10(20-2)16-13(15-9)21-8-5-3-4-7(14)11(8)12(17)18;1-3(2)4/h3-6H,1-2H3,(H,17,18);3H,4H2,1-2H3