1-[3-methanidyl-7-[2-(1-methanidyl-2-methyl-3-naphthalen-1-yl-1H-inden-4-yl)ethyl]-2-methyl-3H-inden-1-yl]naphthalene; zirconium(2+)

Systemtic Name: 1-[3-methanidyl-7-[2-(1-methanidyl-2-methyl-3-naphthalen-1-yl-1H-inden-4-yl)ethyl]-2-methyl-3H-inden-1-yl]naphthalene; zirconium(2+) Openeye Name: 1-[3-methanidyl-7-[2-[1-methanidyl-2-methyl-3-(1-naphthyl)-1H-inden-4-yl]ethyl]-2-methyl-3H-inden-1-yl]naphthalene; zirconium(2+) CAS Name: 1-[3-methanidyl-7-[2-[1-methanidyl-2-methyl-3-(1-naphthalenyl)-1H-inden-4-yl]ethyl]-2-methyl-3H-inden-1-yl]naphthalene; zirconium(2+) IUPAC Name: 1-[3-methanidyl-7-[2-(1-methanidyl-2-methyl-3-naphthalen-1-yl-1H-inden-4-yl)ethyl]-2-methyl-3H-inden-1-yl]naphthalene; zirconium(2+) Traditional Name: 1-[3-methanidyl-7-[2-[1-methanidyl-2-methyl-3-(1-naphthyl)-1H-inden-4-yl]ethyl]-2-methyl-3H-inden-1-yl]naphthalene; zirconium(2+) Formula: C44H36Zr MolecularWeight: 655.98064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1[CH2-])C=CC=C2CCC3=CC=CC4=C3C(=C(C4[CH2-])C)C5=CC=CC6=CC=CC=C65)C7=CC=CC8=CC=CC=C87.[Zr+2]

Isomeric SMILES

CC1=C(C2=C(C1[CH2-])C=CC=C2CCC3=CC=CC4=C3C(=C(C4[CH2-])C)C5=CC=CC6=CC=CC=C65)C7=CC=CC8=CC=CC=C87.[Zr+2]

InChI

InChI=1S/C44H36.Zr/c1-27-29(3)41(39-23-9-15-31-13-5-7-19-37(31)39)43-33(17-11-21-35(27)43)25-26-34-18-12-22-36-28(2)30(4)42(44(34)36)40-24-10-16-32-14-6-8-20-38(32)40;/h5-24,27-28H,1-2,25-26H2,3-4H3;/q-2;+2