4-chloranyl-5-sulfo-naphthalene-1,2-dicarboxylic acid

Systemtic Name: 4-chloranyl-5-sulfo-naphthalene-1,2-dicarboxylic acid Openeye Name: 4-chloro-5-sulfo-naphthalene-1,2-dicarboxylic acid CAS Name: 4-chloro-5-sulfonaphthalene-1,2-dicarboxylic acid IUPAC Name: 4-chloro-5-sulfonaphthalene-1,2-dicarboxylic acid Traditional Name: 4-chloro-5-sulfo-naphthalene-1,2-dicarboxylic acid Formula: C12H7ClO7S MolecularWeight: 330.69778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CC(=C2C(=C1)S(=O)(=O)O)Cl)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=CC(=C2C(=C1)S(=O)(=O)O)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C12H7ClO7S/c13-7-4-6(11(14)15)9(12(16)17)5-2-1-3-8(10(5)7)21(18,19)20/h1-4H,(H,14,15)(H,16,17)(H,18,19,20)