8-sulfoquinoline-4-carboxylic acid

Systemtic Name: 8-sulfoquinoline-4-carboxylic acid Openeye Name: 8-sulfoquinoline-4-carboxylic acid CAS Name: 8-sulfo-4-quinolinecarboxylic acid IUPAC Name: 8-sulfoquinoline-4-carboxylic acid Traditional Name: 8-sulfocinchoninic acid Formula: C10H7NO5S MolecularWeight: 253.23128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2C(=C1)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CN=C2C(=C1)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C10H7NO5S/c12-10(13)7-4-5-11-9-6(7)2-1-3-8(9)17(14,15)16/h1-5H,(H,12,13)(H,14,15,16)