(Z)-4-oxidanylpent-3-en-2-one; N2-phenylcyclohexa-3,5-diene-1,2-diimine; ruthenium

Systemtic Name: (Z)-4-oxidanylpent-3-en-2-one; N2-phenylcyclohexa-3,5-diene-1,2-diimine; ruthenium Openeye Name: (Z)-4-hydroxypent-3-en-2-one; N2-phenylcyclohexa-3,5-diene-1,2-diimine; ruthenium CAS Name: (Z)-4-hydroxy-3-penten-2-one; N2-phenylcyclohexa-3,5-diene-1,2-diimine; ruthenium IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; 2-N-phenylcyclohexa-3,5-diene-1,2-diimine; ruthenium Traditional Name: (Z)-4-hydroxypent-3-en-2-one; (6-iminocyclohexa-2,4-dien-1-ylidene)-phenyl-amine; ruthenium Formula: C22H26N2O4Ru MolecularWeight: 483.52284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.CC(=CC(=O)C)O.C1=CC=C(C=C1)N=C2C=CC=CC2=N.[Ru]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C1=CC=C(C=C1)N=C2C(=N)C=CC=C2.[Ru]

InChI

InChI=1S/C12H10N2.2C5H8O2.Ru/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10;2*1-4(6)3-5(2)7;/h1-9,13H;2*3,6H,1-2H3;/b;2*4-3-;