aluminum 6-oxidanidyl-5-[(4-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate

Systemtic Name: aluminum 6-oxidanidyl-5-[(4-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate Openeye Name: aluminum 6-oxido-5-(4-sulfonatophenyl)azo-naphthalene-2-sulfonate CAS Name: aluminum 6-oxido-5-(4-sulfonatophenyl)azo-2-naphthalenesulfonate IUPAC Name: aluminum 6-oxido-5-[(4-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate Traditional Name: aluminum 6-oxido-5-(4-sulfonatophenyl)azo-naphthalene-2-sulfonate Formula: C16H9AlN2O7S2 MolecularWeight: 432.363398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-].[Al+3]

Isomeric SMILES

C1=CC(=CC=C1N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-].[Al+3]

InChI

InChI=1S/C16H12N2O7S2.Al/c19-15-8-1-10-9-13(27(23,24)25)6-7-14(10)16(15)18-17-11-2-4-12(5-3-11)26(20,21)22;/h1-9,19H,(H,20,21,22)(H,23,24,25);/q;+3/p-3