3,5-dimethylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene

Systemtic Name: 3,5-dimethylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene Openeye Name: 3,5-dimethylphenol; isopropylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene CAS Name: 3,5-dimethylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene IUPAC Name: 3,5-dimethylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene Traditional Name: isopropylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene; 3,5-xylenol Formula: C20H29OTi MolecularWeight: 333.31066

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Descriptors Computed from Structure

Canonical SMILES:

CC1[C-]=C(C(=C1C)C)C.CC1=CC(=CC(=C1)O)C.CC(=[Ti+])C

Isomeric SMILES

CC1[C-]=C(C(=C1C)C)C.CC1=CC(=CC(=C1)O)C.CC(=[Ti+])C

InChI

InChI=1S/C9H13.C8H10O.C3H6.Ti/c1-6-5-7(2)9(4)8(6)3;1-6-3-7(2)5-8(9)4-6;1-3-2;/h6H,1-4H3;3-5,9H,1-2H3;1-2H3;/q-1;;;+1