cyclopenta-1,3-diene; propan-2-ylbenzene; titanium

Systemtic Name: cyclopenta-1,3-diene; propan-2-ylbenzene; titanium Openeye Name: cyclopenta-1,3-diene; 1-methanidylethylbenzene; titanium CAS Name: cyclopenta-1,3-diene; propan-2-ylbenzene; titanium IUPAC Name: cyclopenta-1,3-diene; propan-2-ylbenzene; titanium Traditional Name: cyclopenta-1,3-diene; 1-methanidylethylbenzene; titanium Formula: C19H20Ti-4 MolecularWeight: 296.2291

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C([CH2-])C1=CC=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti]

Isomeric SMILES

[CH2-]C([CH2-])C1=CC=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti]

InChI

InChI=1S/C9H10.2C5H5.Ti/c1-8(2)9-6-4-3-5-7-9;2*1-2-4-5-3-1;/h3-8H,1-2H2;2*1-5H;/q-2;2*-1;