(Z)-2-decylbut-2-enedioate; ethanesulfonate

Systemtic Name: (Z)-2-decylbut-2-enedioate; ethanesulfonate Openeye Name: (Z)-2-decylbut-2-enedioate; ethanesulfonate CAS Name: (Z)-2-decyl-2-butenedioate; ethanesulfonate IUPAC Name: (Z)-2-decylbut-2-enedioate; ethanesulfonate Traditional Name: (Z)-2-decylbut-2-enedioate esylate Formula: C16H27O7S-3 MolecularWeight: 363.44638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=CC(=O)[O-])C(=O)[O-].CCS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCC/C(=C/C(=O)[O-])/C(=O)[O-].CCS(=O)(=O)[O-]

InChI

InChI=1S/C14H24O4.C2H6O3S/c1-2-3-4-5-6-7-8-9-10-12(14(17)18)11-13(15)16;1-2-6(3,4)5/h11H,2-10H2,1H3,(H,15,16)(H,17,18);2H2,1H3,(H,3,4,5)/p-3/b12-11-;