cyclopenta-1,3-diene; N-(3-hydroxyphenyl)methanamide; zirconium(2+)

Systemtic Name: cyclopenta-1,3-diene; N-(3-hydroxyphenyl)methanamide; zirconium(2+) Openeye Name: cyclopenta-1,3-diene; N-(3-hydroxyphenyl)formamide; zirconium(2+) CAS Name: cyclopenta-1,3-diene; N-(3-hydroxyphenyl)formamide; zirconium(2+) IUPAC Name: cyclopenta-1,3-diene; N-(3-hydroxyphenyl)formamide; zirconium(2+) Traditional Name: cyclopenta-1,3-diene; N-(3-hydroxyphenyl)formamide; zirconium(2+) Formula: C24H24N2O4Zr MolecularWeight: 495.68236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC(=CC(=C1)O)NC=O.C1=CC(=CC(=C1)O)NC=O.[Zr+2]

Isomeric SMILES

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC(=CC(=C1)O)NC=O.C1=CC(=CC(=C1)O)NC=O.[Zr+2]

InChI

InChI=1S/2C7H7NO2.2C5H5.Zr/c2*9-5-8-6-2-1-3-7(10)4-6;2*1-2-4-5-3-1;/h2*1-5,10H,(H,8,9);2*1-3H,4H2;/q;;2*-1;+2