(E)-4-(2-ethylhexoxy)-4-oxidanylidene-but-2-enoic acid; phenylmercury

Systemtic Name: (E)-4-(2-ethylhexoxy)-4-oxidanylidene-but-2-enoic acid; phenylmercury Openeye Name: (E)-4-(2-ethylhexoxy)-4-oxo-but-2-enoic acid; phenylmercury CAS Name: (E)-4-(2-ethylhexoxy)-4-oxo-2-butenoic acid; phenylmercury IUPAC Name: (E)-4-(2-ethylhexoxy)-4-oxobut-2-enoic acid; phenylmercury Traditional Name: (E)-4-(2-ethylhexoxy)-4-keto-but-2-enoic acid; phenylmercury Formula: C18H25HgO4 MolecularWeight: 505.9787

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C=CC(=O)O.C1=CC=C(C=C1)[Hg]

Isomeric SMILES

CCCCC(CC)COC(=O)/C=C/C(=O)O.C1=CC=C(C=C1)[Hg]

InChI

InChI=1S/C12H20O4.C6H5.Hg/c1-3-5-6-10(4-2)9-16-12(15)8-7-11(13)14;1-2-4-6-5-3-1;/h7-8,10H,3-6,9H2,1-2H3,(H,13,14);1-5H;/b8-7+;;