2,3-dihydro-1H-inden-5-ol; 2,2-dimethyl-6-oxidanyl-1,3-dioxin-4-one; ethanol; titanium

Systemtic Name: 2,3-dihydro-1H-inden-5-ol; 2,2-dimethyl-6-oxidanyl-1,3-dioxin-4-one; ethanol; titanium Openeye Name: ethanol; 6-hydroxy-2,2-dimethyl-1,3-dioxin-4-one; indan-5-ol; titanium CAS Name: 2,3-dihydro-1H-inden-5-ol; ethanol; 6-hydroxy-2,2-dimethyl-1,3-dioxin-4-one; titanium IUPAC Name: 2,3-dihydro-1H-inden-5-ol; ethanol; 6-hydroxy-2,2-dimethyl-1,3-dioxin-4-one; titanium Traditional Name: ethanol; 6-hydroxy-2,2-dimethyl-1,3-dioxin-4-one; indan-5-ol; titanium Formula: C23H32O10Ti MolecularWeight: 516.36118

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CC1(OC(=CC(=O)O1)O)C.CC1(OC(=CC(=O)O1)O)C.C1CC2=C(C1)C=C(C=C2)O.[Ti]

Isomeric SMILES

CCO.CC1(OC(=CC(=O)O1)O)C.CC1(OC(=CC(=O)O1)O)C.C1CC2=C(C1)C=C(C=C2)O.[Ti]

InChI

InChI=1S/C9H10O.2C6H8O4.C2H6O.Ti/c10-9-5-4-7-2-1-3-8(7)6-9;2*1-6(2)9-4(7)3-5(8)10-6;1-2-3;/h4-6,10H,1-3H2;2*3,7H,1-2H3;3H,2H2,1H3;