calcium 2-methylnaphthalene-1-sulfonate

Systemtic Name: calcium 2-methylnaphthalene-1-sulfonate Openeye Name: calcium 2-methylnaphthalene-1-sulfonate CAS Name: calcium 2-methyl-1-naphthalenesulfonate IUPAC Name: calcium 2-methylnaphthalene-1-sulfonate Traditional Name: calcium 2-methylnaphthalene-1-sulfonate Formula: C22H18CaO6S2 MolecularWeight: 482.58272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].[Ca+2]

Isomeric SMILES

CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].[Ca+2]

InChI

InChI=1S/2C11H10O3S.Ca/c2*1-8-6-7-9-4-2-3-5-10(9)11(8)15(12,13)14;/h2*2-7H,1H3,(H,12,13,14);/q;;+2/p-2