barium(2+); 2-[(2Z)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]naphthalene-1-sulfonate

Systemtic Name: barium(2+); 2-[(2Z)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]naphthalene-1-sulfonate Openeye Name: barium(2+); 2-[(2Z)-2-(2-oxo-1-naphthylidene)hydrazino]naphthalene-1-sulfonate CAS Name: barium(2+); 2-[(2Z)-2-(2-oxo-1-naphthalenylidene)hydrazinyl]-1-naphthalenesulfonate IUPAC Name: barium(2+); 2-[(2Z)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]naphthalene-1-sulfonate Traditional Name: barium(2+); 2-[(N'Z)-N'-(2-keto-1-naphthylidene)hydrazino]naphthalene-1-sulfonate Formula: C40H26BaN4O8S2 MolecularWeight: 892.11344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])NN=C3C(=O)C=CC4=CC=CC=C43.C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])NN=C3C(=O)C=CC4=CC=CC=C43.[Ba+2]

Isomeric SMILES

C1=CC=C2C(=C(C=CC2=C1)N/N=C\3/C4=CC=CC=C4C=CC3=O)S(=O)(=O)[O-].C1=CC=C2C(=C(C=CC2=C1)N/N=C\3/C4=CC=CC=C4C=CC3=O)S(=O)(=O)[O-].[Ba+2]

InChI

InChI=1S/2C20H14N2O4S.Ba/c2*23-18-12-10-13-5-1-3-7-15(13)19(18)22-21-17-11-9-14-6-2-4-8-16(14)20(17)27(24,25)26;/h2*1-12,21H,(H,24,25,26);/q;;+2/p-2/b2*22-19-;