barium(2+); 2-[(2E)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]benzoate

Systemtic Name: barium(2+); 2-[(2E)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]benzoate Openeye Name: barium(2+); 2-[(2E)-2-(2-oxo-1-naphthylidene)hydrazino]benzoate CAS Name: barium(2+); 2-[(2E)-2-(2-oxo-1-naphthalenylidene)hydrazinyl]benzoate IUPAC Name: barium(2+); 2-[(2E)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]benzoate Traditional Name: barium(2+); 2-[(N'E)-N'-(2-keto-1-naphthylidene)hydrazino]benzoate Formula: C34H22BaN4O6 MolecularWeight: 719.88868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=CC=C3C(=O)[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=CC=C3C(=O)[O-].[Ba+2]

Isomeric SMILES

C1=CC=C2/C(=N\NC3=CC=CC=C3C(=O)[O-])/C(=O)C=CC2=C1.C1=CC=C2/C(=N\NC3=CC=CC=C3C(=O)[O-])/C(=O)C=CC2=C1.[Ba+2]

InChI

InChI=1S/2C17H12N2O3.Ba/c2*20-15-10-9-11-5-1-2-6-12(11)16(15)19-18-14-8-4-3-7-13(14)17(21)22;/h2*1-10,18H,(H,21,22);/q;;+2/p-2/b2*19-16+;