barium(2+); 2-[(2Z)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]benzene-1,4-disulfonate

Systemtic Name: barium(2+); 2-[(2Z)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]benzene-1,4-disulfonate Openeye Name: barium(2+); 2-[(2Z)-2-(2-oxo-1-naphthylidene)hydrazino]benzene-1,4-disulfonate CAS Name: barium(2+); 2-[(2Z)-2-(2-oxo-1-naphthalenylidene)hydrazinyl]benzene-1,4-disulfonate IUPAC Name: barium(2+); 2-[(2Z)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]benzene-1,4-disulfonate Traditional Name: barium(2+); 2-[(N'Z)-N'-(2-keto-1-naphthylidene)hydrazino]benzene-1,4-disulfonate Formula: C16H10BaN2O7S2 MolecularWeight: 543.7168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ba+2]

Isomeric SMILES

C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ba+2]

InChI

InChI=1S/C16H12N2O7S2.Ba/c19-14-7-5-10-3-1-2-4-12(10)16(14)18-17-13-9-11(26(20,21)22)6-8-15(13)27(23,24)25;/h1-9,17H,(H,20,21,22)(H,23,24,25);/q;+2/p-2/b18-16-;