sodium (3Z)-5-[(2-hydroxyphenyl)carbonylamino]-3-[(1-methoxysulfonylnaphthalen-2-yl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (3Z)-5-[(2-hydroxyphenyl)carbonylamino]-3-[(1-methoxysulfonylnaphthalen-2-yl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (3Z)-5-[(2-hydroxybenzoyl)amino]-3-[(1-methoxysulfonyl-2-naphthyl)hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: sodium (3Z)-5-[[(2-hydroxyphenyl)-oxomethyl]amino]-3-[(1-methoxysulfonyl-2-naphthalenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: sodium (3Z)-5-[(2-hydroxybenzoyl)amino]-3-[(1-methoxysulfonylnaphthalen-2-yl)hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: sodium (3Z)-4-keto-3-[(1-methoxysulfonyl-2-naphthyl)hydrazono]-5-(salicyloylamino)naphthalene-2-sulfonate Formula: C28H20N3NaO9S2 MolecularWeight: 629.59287

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=C(C=CC2=CC=CC=C21)NN=C3C(=CC4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=CC=C5O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

COS(=O)(=O)C1=C(C=CC2=CC=CC=C21)N/N=C/3\C(=CC4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=CC=C5O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C28H21N3O9S2.Na/c1-40-42(38,39)27-18-9-3-2-7-16(18)13-14-21(27)30-31-25-23(41(35,36)37)15-17-8-6-11-20(24(17)26(25)33)29-28(34)19-10-4-5-12-22(19)32;/h2-15,30,32H,1H3,(H,29,34)(H,35,36,37);/q;+1/p-1/b31-25+;