calcium 2-propylnaphthalene-1-sulfonate

Systemtic Name: calcium 2-propylnaphthalene-1-sulfonate Openeye Name: calcium 2-propylnaphthalene-1-sulfonate CAS Name: calcium 2-propyl-1-naphthalenesulfonate IUPAC Name: calcium 2-propylnaphthalene-1-sulfonate Traditional Name: calcium 2-propylnaphthalene-1-sulfonate Formula: C26H26CaO6S2 MolecularWeight: 538.68904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].CCCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].[Ca+2]

Isomeric SMILES

CCCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].CCCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].[Ca+2]

InChI

InChI=1S/2C13H14O3S.Ca/c2*1-2-5-11-9-8-10-6-3-4-7-12(10)13(11)17(14,15)16;/h2*3-4,6-9H,2,5H2,1H3,(H,14,15,16);/q;;+2/p-2