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1,6,7-tris(chloranyl)-4-oxidanyl-isoquinoline-3-carboxylic acid

1,6,7-tris(chloranyl)-4-oxidanyl-isoquinoline-3-carboxylic acid

Systemtic Name:1,6,7-tris(chloranyl)-4-oxidanyl-isoquinoline-3-carboxylic acid
Openeye Name:1,6,7-trichloro-4-hydroxy-isoquinoline-3-carboxylic acid
CAS Name:1,6,7-trichloro-4-hydroxy-3-isoquinolinecarboxylic acid
IUPAC Name:1,6,7-trichloro-4-hydroxyisoquinoline-3-carboxylic acid
Traditional Name:1,6,7-trichloro-4-hydroxy-isoquinoline-3-carboxylic acid
Formula: C10H4Cl3NO3
MolecularWeight: 292.50266
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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=CC(=C1Cl)Cl)C(=NC(=C2O)C(=O)O)Cl


Isomeric SMILES

C1=C2C(=CC(=C1Cl)Cl)C(=NC(=C2O)C(=O)O)Cl


InChI

InChI=1S/C10H4Cl3NO3/c11-5-1-3-4(2-6(5)12)9(13)14-7(8(3)15)10(16)17/h1-2,15H,(H,16,17)


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