2-(3H-cyclopenta[a]naphthalen-3-id-2-yl)furan; titanium(4+); dichloride

Systemtic Name: 2-(3H-cyclopenta[a]naphthalen-3-id-2-yl)furan; titanium(4+); dichloride Openeye Name: 2-(3H-cyclopenta[a]naphthalen-3-id-2-yl)furan; titanium(4+); dichloride CAS Name: 2-(3H-cyclopenta[a]naphthalen-3-id-2-yl)furan; titanium(4+); dichloride IUPAC Name: 2-(3H-cyclopenta[a]naphthalen-3-id-2-yl)furan; titanium(4+); dichloride Traditional Name: 2-(3H-benz[e]inden-3-id-2-yl)furan; titanium(4+); dichloride Formula: C34H22Cl2O2Ti MolecularWeight: 581.31028

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=C(C=C1C3=CC=CO3)C4=CC=CC=C4C=C2.[CH-]1C2=C(C=C1C3=CC=CO3)C4=CC=CC=C4C=C2.[Cl-].[Cl-].[Ti+4]

Isomeric SMILES

[CH-]1C2=C(C=C1C3=CC=CO3)C4=CC=CC=C4C=C2.[CH-]1C2=C(C=C1C3=CC=CO3)C4=CC=CC=C4C=C2.[Cl-].[Cl-].[Ti+4]

InChI

InChI=1S/2C17H11O.2ClH.Ti/c2*1-2-5-15-12(4-1)7-8-13-10-14(11-16(13)15)17-6-3-9-18-17;;;/h2*1-11H;2*1H;/q2*-1;;;+4/p-2