4-oxidanyl-5-[(3-sulfophenyl)carbonylamino]naphthalene-2,7-disulfonic acid

Systemtic Name: 4-oxidanyl-5-[(3-sulfophenyl)carbonylamino]naphthalene-2,7-disulfonic acid Openeye Name: 4-hydroxy-5-[(3-sulfobenzoyl)amino]naphthalene-2,7-disulfonic acid CAS Name: 4-hydroxy-5-[[oxo-(3-sulfophenyl)methyl]amino]naphthalene-2,7-disulfonic acid IUPAC Name: 4-hydroxy-5-[(3-sulfobenzoyl)amino]naphthalene-2,7-disulfonic acid Traditional Name: 4-hydroxy-5-[(3-sulfobenzoyl)amino]naphthalene-2,7-disulfonic acid Formula: C17H13NO11S3 MolecularWeight: 503.48022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

InChI

InChI=1S/C17H13NO11S3/c19-15-8-13(32(27,28)29)6-10-5-12(31(24,25)26)7-14(16(10)15)18-17(20)9-2-1-3-11(4-9)30(21,22)23/h1-8,19H,(H,18,20)(H,21,22,23)(H,24,25,26)(H,27,28,29)