4-azanyl-3-sulfo-naphthalene-1,8-dicarboxylic acid

Systemtic Name: 4-azanyl-3-sulfo-naphthalene-1,8-dicarboxylic acid Openeye Name: 4-amino-3-sulfo-naphthalene-1,8-dicarboxylic acid CAS Name: 4-amino-3-sulfonaphthalene-1,8-dicarboxylic acid IUPAC Name: 4-amino-3-sulfonaphthalene-1,8-dicarboxylic acid Traditional Name: 4-amino-3-sulfo-naphthalic acid Formula: C12H9NO7S MolecularWeight: 311.26736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)O)C(=CC(=C2N)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)O)C(=CC(=C2N)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C12H9NO7S/c13-10-5-2-1-3-6(11(14)15)9(5)7(12(16)17)4-8(10)21(18,19)20/h1-4H,13H2,(H,14,15)(H,16,17)(H,18,19,20)