calcium 4-dodecylbenzenesulfonic acid

Systemtic Name: calcium 4-dodecylbenzenesulfonic acid Openeye Name: calcium 4-dodecylbenzenesulfonic acid CAS Name: calcium 4-dodecylbenzenesulfonic acid IUPAC Name: calcium 4-dodecylbenzenesulfonic acid Traditional Name: calcium 4-laurylbesylic acid Formula: C18H30CaO3S+2 MolecularWeight: 366.572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.[Ca+2]

InChI

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