isoquinoline-2,3,3-tricarboxylic acid

Systemtic Name: isoquinoline-2,3,3-tricarboxylic acid Openeye Name: isoquinoline-2,3,3-tricarboxylic acid CAS Name: isoquinoline-2,3,3-tricarboxylic acid IUPAC Name: isoquinoline-2,3,3-tricarboxylic acid Traditional Name: isoquinoline-2,3,3-tricarboxylic acid Formula: C12H9NO6 MolecularWeight: 263.20296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(N(C=C2C=C1)C(=O)O)(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=CC(N(C=C2C=C1)C(=O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C12H9NO6/c14-9(15)12(10(16)17)5-7-3-1-2-4-8(7)6-13(12)11(18)19/h1-6H,(H,14,15)(H,16,17)(H,18,19)