4-dodecylbenzenesulfonic acid; propan-2-ol; titanium

Systemtic Name: 4-dodecylbenzenesulfonic acid; propan-2-ol; titanium Openeye Name: 4-dodecylbenzenesulfonic acid; propan-2-ol; titanium CAS Name: 4-dodecylbenzenesulfonic acid; 2-propanol; titanium IUPAC Name: 4-dodecylbenzenesulfonic acid; propan-2-ol; titanium Traditional Name: 4-laurylbesylic acid; propan-2-ol; titanium Formula: C21H38O4STi MolecularWeight: 434.45602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CC(C)O.[Ti]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CC(C)O.[Ti]

InChI

InChI=1S/C18H30O3S.C3H8O.Ti/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21;1-3(2)4;/h13-16H,2-12H2,1H3,(H,19,20,21);3-4H,1-2H3;