4-[(E)-dodec-1-enoxy]-4-oxidanylidene-butanoate; phenylmercury(1+)

Systemtic Name: 4-[(E)-dodec-1-enoxy]-4-oxidanylidene-butanoate; phenylmercury(1+) Openeye Name: 4-[(E)-dodec-1-enoxy]-4-oxo-butanoate; phenylmercury(1+) CAS Name: 4-[(E)-dodec-1-enoxy]-4-oxobutanoate; phenylmercury(1+) IUPAC Name: 4-[(E)-dodec-1-enoxy]-4-oxobutanoate; phenylmercury(1+) Traditional Name: 4-[(E)-dodec-1-enoxy]-4-keto-butyrate; phenylmercury(1+) Formula: C22H32HgO4 MolecularWeight: 561.07708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=COC(=O)CCC(=O)[O-].C1=CC=C(C=C1)[Hg+]

Isomeric SMILES

CCCCCCCCCC/C=C/OC(=O)CCC(=O)[O-].C1=CC=C(C=C1)[Hg+]

InChI

InChI=1S/C16H28O4.C6H5.Hg/c1-2-3-4-5-6-7-8-9-10-11-14-20-16(19)13-12-15(17)18;1-2-4-6-5-3-1;/h11,14H,2-10,12-13H2,1H3,(H,17,18);1-5H;/q;;+1/p-1/b14-11+;;