chloranylruthenium; pyridine-2-carboxylic acid; 6-[(Z)-1H-pyridin-2-ylidenemethyl]iminocyclohexa-2,4-dien-1-one; hydrate

Systemtic Name: chloranylruthenium; pyridine-2-carboxylic acid; 6-[(Z)-1H-pyridin-2-ylidenemethyl]iminocyclohexa-2,4-dien-1-one; hydrate Openeye Name: chlororuthenium; pyridine-2-carboxylic acid; 6-[(Z)-1H-pyridin-2-ylidenemethyl]iminocyclohexa-2,4-dien-1-one; hydrate CAS Name: chlororuthenium; 2-pyridinecarboxylic acid; 6-[(Z)-1H-pyridin-2-ylidenemethyl]imino-1-cyclohexa-2,4-dienone; hydrate IUPAC Name: chlororuthenium; pyridine-2-carboxylic acid; 6-[(Z)-1H-pyridin-2-ylidenemethyl]iminocyclohexa-2,4-dien-1-one; hydrate Traditional Name: chlororuthenium; picolinic acid; 6-[(Z)-1H-pyridin-2-ylidenemethyl]iminocyclohexa-2,4-dien-1-one; hydrate Formula: C18H17ClN3O4Ru MolecularWeight: 475.86828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)O.C1=CC(=NC=C2C=CC=CN2)C(=O)C=C1.O.Cl[Ru]

Isomeric SMILES

C1=CC=NC(=C1)C(=O)O.C1=CC(=N/C=C\2/C=CC=CN2)C(=O)C=C1.O.Cl[Ru]

InChI

InChI=1S/C12H10N2O.C6H5NO2.ClH.H2O.Ru/c15-12-7-2-1-6-11(12)14-9-10-5-3-4-8-13-10;8-6(9)5-3-1-2-4-7-5;;;/h1-9,13H;1-4H,(H,8,9);1H;1H2;/q;;;;+1/p-1/b10-9-,14-11?;;;;