4-[(4-benzamidophenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid; sodium

Systemtic Name: 4-[(4-benzamidophenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid; sodium Openeye Name: 4-[(4-benzamidobenzoyl)amino]-5-hydroxy-naphthalene-2,7-disulfonic acid; sodium CAS Name: 4-[[(4-benzamidophenyl)-oxomethyl]amino]-5-hydroxynaphthalene-2,7-disulfonic acid; sodium IUPAC Name: 4-[(4-benzamidobenzoyl)amino]-5-hydroxynaphthalene-2,7-disulfonic acid; sodium Traditional Name: 4-[(4-benzamidobenzoyl)amino]-5-hydroxy-naphthalene-2,7-disulfonic acid; sodium Formula: C24H18N2NaO9S2 MolecularWeight: 565.52749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C=C4O)S(=O)(=O)O.[Na]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C=C4O)S(=O)(=O)O.[Na]

InChI

InChI=1S/C24H18N2O9S2.Na/c27-21-13-19(37(33,34)35)11-16-10-18(36(30,31)32)12-20(22(16)21)26-24(29)15-6-8-17(9-7-15)25-23(28)14-4-2-1-3-5-14;/h1-13,27H,(H,25,28)(H,26,29)(H,30,31,32)(H,33,34,35);