dilithium (3E)-6-acetamido-4-oxidanylidene-3-[[4-(1-sulfonatooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonate

Systemtic Name: dilithium (3E)-6-acetamido-4-oxidanylidene-3-[[4-(1-sulfonatooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonate Openeye Name: dilithium (3E)-6-acetamido-4-oxo-3-[[4-(1-sulfonatooxyethylsulfonyl)phenyl]hydrazono]naphthalene-2-sulfonate CAS Name: dilithium (3E)-6-acetamido-4-oxo-3-[[4-(1-sulfonatooxyethylsulfonyl)phenyl]hydrazinylidene]-2-naphthalenesulfonate IUPAC Name: dilithium (3E)-6-acetamido-4-oxo-3-[[4-(1-sulfonatooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonate Traditional Name: dilithium (3E)-6-acetamido-4-keto-3-[[4-(1-sulfatoethylsulfonyl)phenyl]hydrazono]naphthalene-2-sulfonate Formula: C20H17Li2N3O11S3 MolecularWeight: 585.43948

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].CC(OS(=O)(=O)[O-])S(=O)(=O)C1=CC=C(C=C1)NN=C2C(=CC3=C(C2=O)C=C(C=C3)NC(=O)C)S(=O)(=O)[O-]

Isomeric SMILES

[Li+].[Li+].CC(OS(=O)(=O)[O-])S(=O)(=O)C1=CC=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)NC(=O)C)S(=O)(=O)[O-]

InChI

InChI=1S/C20H19N3O11S3.2Li/c1-11(24)21-15-4-3-13-9-18(36(28,29)30)19(20(25)17(13)10-15)23-22-14-5-7-16(8-6-14)35(26,27)12(2)34-37(31,32)33;;/h3-10,12,22H,1-2H3,(H,21,24)(H,28,29,30)(H,31,32,33);;/q;2*+1/p-2/b23-19-;;