4-(6-oxidanyldodecan-2-yl)benzenesulfonate

Systemtic Name: 4-(6-oxidanyldodecan-2-yl)benzenesulfonate Openeye Name: 4-(5-hydroxy-1-methyl-undecyl)benzenesulfonate CAS Name: 4-(6-hydroxydodecan-2-yl)benzenesulfonate IUPAC Name: 4-(6-hydroxydodecan-2-yl)benzenesulfonate Traditional Name: 4-(5-hydroxy-1-methyl-undecyl)besylate Formula: C18H29O4S- MolecularWeight: 341.48546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCC(C)C1=CC=C(C=C1)S(=O)(=O)[O-])O

Isomeric SMILES

CCCCCCC(CCCC(C)C1=CC=C(C=C1)S(=O)(=O)[O-])O

InChI

InChI=1S/C18H30O4S/c1-3-4-5-6-9-17(19)10-7-8-15(2)16-11-13-18(14-12-16)23(20,21)22/h11-15,17,19H,3-10H2,1-2H3,(H,20,21,22)/p-1