cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+)

Systemtic Name: cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+) Openeye Name: cyclopenta-1,3-diene; isopropylidenetitanium(1+); phenol CAS Name: cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+) IUPAC Name: cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+) Traditional Name: cyclopenta-1,3-diene; isopropylidenetitanium(1+); phenol Formula: C14H17OTi MolecularWeight: 249.15118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=[Ti+])C.C1C=CC=[C-]1.C1=CC=C(C=C1)O

Isomeric SMILES

CC(=[Ti+])C.C1C=CC=[C-]1.C1=CC=C(C=C1)O

InChI

InChI=1S/C6H6O.C5H5.C3H6.Ti/c7-6-4-2-1-3-5-6;1-2-4-5-3-1;1-3-2;/h1-5,7H;1-3H,4H2;1-2H3;/q;-1;;+1