methanal; 2-methylidene-4-phenyl-butanoate; molybdenum

Systemtic Name: methanal; 2-methylidene-4-phenyl-butanoate; molybdenum Openeye Name: formaldehyde; 2-methylene-4-phenyl-butanoate; molybdenum CAS Name: formaldehyde; 2-methylene-4-phenylbutanoate; molybdenum IUPAC Name: formaldehyde; 2-methylidene-4-phenylbutanoate; molybdenum Traditional Name: formaldehyde; molybdenum; 2-phenethylacrylate Formula: C69H72MoO15-6 MolecularWeight: 1237.24098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=O.C=O.C=O.[Mo]

Isomeric SMILES

C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=C(CCC1=CC=CC=C1)C(=O)[O-].C=O.C=O.C=O.[Mo]

InChI

InChI=1S/6C11H12O2.3CH2O.Mo/c6*1-9(11(12)13)7-8-10-5-3-2-4-6-10;3*1-2;/h6*2-6H,1,7-8H2,(H,12,13);3*1H2;/p-6