calcium (E)-hexadec-1-ene-1-sulfonic acid

Systemtic Name: calcium (E)-hexadec-1-ene-1-sulfonic acid Openeye Name: calcium (E)-hexadec-1-ene-1-sulfonic acid CAS Name: calcium (E)-1-hexadecene-1-sulfonic acid IUPAC Name: calcium (E)-hexadec-1-ene-1-sulfonic acid Traditional Name: calcium (E)-hexadec-1-ene-1-sulfonic acid Formula: C16H32CaO3S+2 MolecularWeight: 344.56648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=CS(=O)(=O)O.[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/S(=O)(=O)O.[Ca+2]

InChI

InChI=1S/C16H32O3S.Ca/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(17,18)19;/h15-16H,2-14H2,1H3,(H,17,18,19);/q;+2/b16-15+;