(Z,3E)-3-(1-oxidanylethylidene)-6-phenyl-hex-5-en-2-one; propan-2-ol; titanium

Systemtic Name: (Z,3E)-3-(1-oxidanylethylidene)-6-phenyl-hex-5-en-2-one; propan-2-ol; titanium Openeye Name: (Z,3E)-3-(1-hydroxyethylidene)-6-phenyl-hex-5-en-2-one; propan-2-ol; titanium CAS Name: (Z,3E)-3-(1-hydroxyethylidene)-6-phenyl-5-hexen-2-one; 2-propanol; titanium IUPAC Name: (Z,3E)-3-(1-hydroxyethylidene)-6-phenylhex-5-en-2-one; propan-2-ol; titanium Traditional Name: (Z,3E)-3-(1-hydroxyethylidene)-6-phenyl-hex-5-en-2-one; propan-2-ol; titanium Formula: C23H40O5Ti MolecularWeight: 444.4277

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)O.CC(C)O.CC(C)O.C/C(=C(/C/C=C\C1=CC=CC=C1)\C(=O)C)/O.[Ti]

InChI

InChI=1S/C14H16O2.3C3H8O.Ti/c1-11(15)14(12(2)16)10-6-9-13-7-4-3-5-8-13;3*1-3(2)4;/h3-9,15H,10H2,1-2H3;3*3-4H,1-2H3;/b9-6-,14-11+;;;;