aluminum (5E)-6-oxidanylidene-5-[(4-sulfophenyl)hydrazinylidene]naphthalene-2-sulfonic acid

Systemtic Name: aluminum (5E)-6-oxidanylidene-5-[(4-sulfophenyl)hydrazinylidene]naphthalene-2-sulfonic acid Openeye Name: aluminum (5E)-6-oxo-5-[(4-sulfophenyl)hydrazono]naphthalene-2-sulfonic acid CAS Name: aluminum (5E)-6-oxo-5-[(4-sulfophenyl)hydrazinylidene]-2-naphthalenesulfonic acid IUPAC Name: aluminum (5E)-6-oxo-5-[(4-sulfophenyl)hydrazinylidene]naphthalene-2-sulfonic acid Traditional Name: aluminum (5E)-6-keto-5-[(4-sulfophenyl)hydrazono]naphthalene-2-sulfonic acid Formula: C16H12AlN2O7S2+3 MolecularWeight: 435.387218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)O)S(=O)(=O)O.[Al+3]

Isomeric SMILES

C1=CC(=CC=C1N/N=C/2\C3=C(C=CC2=O)C=C(C=C3)S(=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;/h1-9,17H,(H,20,21,22)(H,23,24,25);/q;+3/b18-16+;