barium(2+); (4Z)-4-(naphthalen-1-ylhydrazinylidene)-3-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: barium(2+); (4Z)-4-(naphthalen-1-ylhydrazinylidene)-3-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: barium(2+); (4Z)-4-(1-naphthylhydrazono)-3-oxo-naphthalene-2,7-disulfonate CAS Name: barium(2+); (4Z)-4-(1-naphthalenylhydrazinylidene)-3-oxonaphthalene-2,7-disulfonate IUPAC Name: barium(2+); (4Z)-4-(naphthalen-1-ylhydrazinylidene)-3-oxonaphthalene-2,7-disulfonate Traditional Name: barium(2+); (4Z)-3-keto-4-(1-naphthylhydrazono)naphthalene-2,7-disulfonate Formula: C20H12BaN2O7S2 MolecularWeight: 593.77548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NN=C3C4=C(C=C(C=C4)S(=O)(=O)[O-])C=C(C3=O)S(=O)(=O)[O-].[Ba+2]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N/N=C\3/C4=C(C=C(C=C4)S(=O)(=O)[O-])C=C(C3=O)S(=O)(=O)[O-].[Ba+2]

InChI

InChI=1S/C20H14N2O7S2.Ba/c23-20-18(31(27,28)29)11-13-10-14(30(24,25)26)8-9-16(13)19(20)22-21-17-7-3-5-12-4-1-2-6-15(12)17;/h1-11,21H,(H,24,25,26)(H,27,28,29);/q;+2/p-2/b22-19-;