2,21-dimethyl-4,5-bis(oxidanyl)docos-1-ene-3,6-dione; oxidanylidenetitanium

Systemtic Name: 2,21-dimethyl-4,5-bis(oxidanyl)docos-1-ene-3,6-dione; oxidanylidenetitanium Openeye Name: 4,5-dihydroxy-2,21-dimethyl-docos-1-ene-3,6-dione; oxotitanium CAS Name: 4,5-dihydroxy-2,21-dimethyl-1-docosene-3,6-dione; oxotitanium IUPAC Name: 4,5-dihydroxy-2,21-dimethyldocos-1-ene-3,6-dione; oxotitanium Traditional Name: 4,5-dihydroxy-2,21-dimethyl-docos-1-ene-3,6-dione; ketotitanium Formula: C24H44O5Ti MolecularWeight: 460.47016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H44O4.O.Ti/c1-19(2)17-15-13-11-9-7-5-6-8-10-12-14-16-18-21(25)23(27)24(28)22(26)20(3)4;;/h19,23-24,27-28H,3,5-18H2,1-2,4H3;;