1-chloranyl-6-methoxy-4-oxidanyl-isoquinoline-3-carboxylic acid

Systemtic Name: 1-chloranyl-6-methoxy-4-oxidanyl-isoquinoline-3-carboxylic acid Openeye Name: 1-chloro-4-hydroxy-6-methoxy-isoquinoline-3-carboxylic acid CAS Name: 1-chloro-4-hydroxy-6-methoxy-3-isoquinolinecarboxylic acid IUPAC Name: 1-chloro-4-hydroxy-6-methoxyisoquinoline-3-carboxylic acid Traditional Name: 1-chloro-4-hydroxy-6-methoxy-isoquinoline-3-carboxylic acid Formula: C11H8ClNO4 MolecularWeight: 253.63852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=C2O)C(=O)O)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=C2O)C(=O)O)Cl

InChI

InChI=1S/C11H8ClNO4/c1-17-5-2-3-6-7(4-5)9(14)8(11(15)16)13-10(6)12/h2-4,14H,1H3,(H,15,16)