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2-chloranyl-6-[(4,6-dimethoxypyrimidin-2-yl)-oxidanyl-methyl]benzoic acid

2-chloranyl-6-[(4,6-dimethoxypyrimidin-2-yl)-oxidanyl-methyl]benzoic acid

Systemtic Name:2-chloranyl-6-[(4,6-dimethoxypyrimidin-2-yl)-oxidanyl-methyl]benzoic acid
Openeye Name:2-chloro-6-[(4,6-dimethoxypyrimidin-2-yl)-hydroxy-methyl]benzoic acid
CAS Name:2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)-hydroxymethyl]benzoic acid
IUPAC Name:2-chloro-6-[(4,6-dimethoxypyrimidin-2-yl)-hydroxymethyl]benzoic acid
Traditional Name:2-chloro-6-[(4,6-dimethoxypyrimidin-2-yl)-hydroxy-methyl]benzoic acid
Formula: C14H13ClN2O5
MolecularWeight: 324.71642
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C(C2=C(C(=CC=C2)Cl)C(=O)O)O)OC


Isomeric SMILES

COC1=CC(=NC(=N1)C(C2=C(C(=CC=C2)Cl)C(=O)O)O)OC


InChI

InChI=1S/C14H13ClN2O5/c1-21-9-6-10(22-2)17-13(16-9)12(18)7-4-3-5-8(15)11(7)14(19)20/h3-6,12,18H,1-2H3,(H,19,20)


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