2-(4-naphthalen-2-yl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+)

Systemtic Name: 2-(4-naphthalen-2-yl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+) Openeye Name: 2-[4-(2-naphthyl)-1H-inden-1-id-2-yl]-5-propyl-furan; zirconium(2+) CAS Name: 2-[4-(2-naphthalenyl)-1H-inden-1-id-2-yl]-5-propylfuran; zirconium(2+) IUPAC Name: 2-(4-naphthalen-2-yl-1H-inden-1-id-2-yl)-5-propylfuran; zirconium(2+) Traditional Name: 2-[4-(2-naphthyl)-1H-inden-1-id-2-yl]-5-propyl-furan; zirconium(2+) Formula: C52H42O2Zr MolecularWeight: 790.11268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC5=CC=CC=C5C=C4.CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC5=CC=CC=C5C=C4.[Zr+2]

Isomeric SMILES

CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC5=CC=CC=C5C=C4.CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC5=CC=CC=C5C=C4.[Zr+2]

InChI

InChI=1S/2C26H21O.Zr/c2*1-2-6-23-13-14-26(27-23)22-16-20-9-5-10-24(25(20)17-22)21-12-11-18-7-3-4-8-19(18)15-21;/h2*3-5,7-17H,2,6H2,1H3;/q2*-1;+2