2-dodecylbenzenesulfonic acid; methyl 2-methoxy-2-methyl-propanoate; methyl 2-methyl-2-oxidanyl-propanoate

Systemtic Name: 2-dodecylbenzenesulfonic acid; methyl 2-methoxy-2-methyl-propanoate; methyl 2-methyl-2-oxidanyl-propanoate Openeye Name: 2-dodecylbenzenesulfonic acid; methyl 2-hydroxy-2-methyl-propanoate; methyl 2-methoxy-2-methyl-propanoate CAS Name: 2-dodecylbenzenesulfonic acid; 2-hydroxy-2-methylpropanoic acid methyl ester; 2-methoxy-2-methylpropanoic acid methyl ester IUPAC Name: 2-dodecylbenzenesulfonic acid; methyl 2-hydroxy-2-methylpropanoate; methyl 2-methoxy-2-methylpropanoate Traditional Name: 2-hydroxy-2-methyl-propionic acid methyl ester; 2-laurylbesylic acid; 2-methoxy-2-methyl-propionic acid methyl ester Formula: C29H52O9S MolecularWeight: 576.78278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CC(C)(C(=O)OC)O.CC(C)(C(=O)OC)OC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CC(C)(C(=O)OC)O.CC(C)(C(=O)OC)OC

InChI

InChI=1S/C18H30O3S.C6H12O3.C5H10O3/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;1-6(2,9-4)5(7)8-3;1-5(2,7)4(6)8-3/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);1-4H3;7H,1-3H3