bis(2-ethyl-1-methanidyl-3-naphthalen-1-yl-1H-inden-4-yl)-methyl-phenyl-silane; titanium(2+)

Systemtic Name: bis(2-ethyl-1-methanidyl-3-naphthalen-1-yl-1H-inden-4-yl)-methyl-phenyl-silane; titanium(2+) Openeye Name: bis[2-ethyl-1-methanidyl-3-(1-naphthyl)-1H-inden-4-yl]-methyl-phenyl-silane; titanium(2+) CAS Name: bis[2-ethyl-1-methanidyl-3-(1-naphthalenyl)-1H-inden-4-yl]-methyl-phenylsilane; titanium(2+) IUPAC Name: bis(2-ethyl-1-methanidyl-3-naphthalen-1-yl-1H-inden-4-yl)-methyl-phenylsilane; titanium(2+) Traditional Name: bis[2-ethyl-1-methanidyl-3-(1-naphthyl)-1H-inden-4-yl]-methyl-phenyl-silane; titanium(2+) Formula: C51H44SiTi MolecularWeight: 732.84756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C1[CH2-])C=CC=C2[Si](C)(C3=CC=CC=C3)C4=CC=CC5=C4C(=C(C5[CH2-])CC)C6=CC=CC7=CC=CC=C76)C8=CC=CC9=CC=CC=C98.[Ti+2]

Isomeric SMILES

CCC1=C(C2=C(C1[CH2-])C=CC=C2[Si](C)(C3=CC=CC=C3)C4=CC=CC5=C4C(=C(C5[CH2-])CC)C6=CC=CC7=CC=CC=C76)C8=CC=CC9=CC=CC=C98.[Ti+2]

InChI

InChI=1S/C51H44Si.Ti/c1-6-38-33(3)40-27-17-31-46(50(40)48(38)44-29-15-21-35-19-11-13-25-42(35)44)52(5,37-23-9-8-10-24-37)47-32-18-28-41-34(4)39(7-2)49(51(41)47)45-30-16-22-36-20-12-14-26-43(36)45;/h8-34H,3-4,6-7H2,1-2,5H3;/q-2;+2