calcium 4-nonylbenzenesulfonic acid

Systemtic Name: calcium 4-nonylbenzenesulfonic acid Openeye Name: calcium 4-nonylbenzenesulfonic acid CAS Name: calcium 4-nonylbenzenesulfonic acid IUPAC Name: calcium 4-nonylbenzenesulfonic acid Traditional Name: calcium 4-nonylbesylic acid Formula: C15H24CaO3S+2 MolecularWeight: 324.49226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.[Ca+2]

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.[Ca+2]

InChI

InChI=1S/C15H24O3S.Ca/c1-2-3-4-5-6-7-8-9-14-10-12-15(13-11-14)19(16,17)18;/h10-13H,2-9H2,1H3,(H,16,17,18);/q;+2