(Z)-4-oxidanylpent-3-en-2-one; propan-2-ol; titanium

Systemtic Name: (Z)-4-oxidanylpent-3-en-2-one; propan-2-ol; titanium Openeye Name: (Z)-4-hydroxypent-3-en-2-one; propan-2-ol; titanium CAS Name: (Z)-4-hydroxy-3-penten-2-one; 2-propanol; titanium IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; propan-2-ol; titanium Traditional Name: (Z)-4-hydroxypent-3-en-2-one; propan-2-ol; titanium Formula: C16H32O6Ti MolecularWeight: 368.28868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C5H8O2.2C3H8O.Ti/c2*1-4(6)3-5(2)7;2*1-3(2)4;/h2*3,6H,1-2H3;2*3-4H,1-2H3;/b2*4-3-;;;