2-(1H-inden-1-id-2-yl)-5-phenyl-thiophene; 2-methylcyclopenta[b]pyrrole; zirconium(3+); dichloride

Systemtic Name: 2-(1H-inden-1-id-2-yl)-5-phenyl-thiophene; 2-methylcyclopenta[b]pyrrole; zirconium(3+); dichloride Openeye Name: 2-(1H-inden-1-id-2-yl)-5-phenyl-thiophene; 2-methylcyclopenta[b]pyrrole; zirconium(3+); dichloride CAS Name: 2-(1H-inden-1-id-2-yl)-5-phenylthiophene; 2-methylcyclopenta[b]pyrrole; zirconium(3+); dichloride IUPAC Name: 2-(1H-inden-1-id-2-yl)-5-phenylthiophene; 2-methylcyclopenta[b]pyrrole; zirconium(3+); dichloride Traditional Name: 2-(1H-inden-1-id-2-yl)-5-phenyl-thiophene; 2-methylcyclopenta[b]pyrrole; zirconium(3+); dichloride Formula: C27H20Cl2NSZr MolecularWeight: 552.6494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC2=N1.[CH-]1C2=CC=CC=C2C=C1C3=CC=C(S3)C4=CC=CC=C4.[Cl-].[Cl-].[Zr+3]

Isomeric SMILES

CC1=CC2=CC=CC2=N1.[CH-]1C2=CC=CC=C2C=C1C3=CC=C(S3)C4=CC=CC=C4.[Cl-].[Cl-].[Zr+3]

InChI

InChI=1S/C19H13S.C8H7N.2ClH.Zr/c1-2-6-14(7-3-1)18-10-11-19(20-18)17-12-15-8-4-5-9-16(15)13-17;1-6-5-7-3-2-4-8(7)9-6;;;/h1-13H;2-5H,1H3;2*1H;/q-1;;;;+3/p-2