cyclopentane; 4-methylbenzenesulfonic acid; titanium(2+)

Systemtic Name: cyclopentane; 4-methylbenzenesulfonic acid; titanium(2+) Openeye Name: cyclopentane; 4-methylbenzenesulfonic acid; titanium(2+) CAS Name: cyclopentane; 4-methylbenzenesulfonic acid; titanium(2+) IUPAC Name: cyclopentane; 4-methylbenzenesulfonic acid; titanium(2+) Traditional Name: cyclopentane; titanium(2+); tosylic acid Formula: C24H26O6S2Ti+2 MolecularWeight: 522.45664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+2]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+2]

InChI

InChI=1S/2C7H8O3S.2C5H5.Ti/c2*1-6-2-4-7(5-3-6)11(8,9)10;2*1-2-4-5-3-1;/h2*2-5H,1H3,(H,8,9,10);2*1-5H;/q;;;;+2