(E)-3-(1-adamantyl)-2-methyl-prop-2-enoate; (Z)-5-ethyl-2-methyl-non-2-enoate

Systemtic Name: (E)-3-(1-adamantyl)-2-methyl-prop-2-enoate; (Z)-5-ethyl-2-methyl-non-2-enoate Openeye Name: (E)-3-(1-adamantyl)-2-methyl-prop-2-enoate; (Z)-5-ethyl-2-methyl-non-2-enoate CAS Name: (E)-3-(1-adamantyl)-2-methyl-2-propenoate; (Z)-5-ethyl-2-methyl-2-nonenoate IUPAC Name: (E)-3-(1-adamantyl)-2-methylprop-2-enoate; (Z)-5-ethyl-2-methylnon-2-enoate Traditional Name: (E)-3-(1-adamantyl)-2-methyl-acrylate; (Z)-5-ethyl-2-methyl-non-2-enoate Formula: C26H40O4-2 MolecularWeight: 416.5934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC=C(C)C(=O)[O-].CC(=CC12CC3CC(C1)CC(C3)C2)C(=O)[O-]

Isomeric SMILES

CCCCC(CC)C/C=C(/C)\C(=O)[O-].C/C(=C\C12CC3CC(C1)CC(C3)C2)/C(=O)[O-]

InChI

InChI=1S/C14H20O2.C12H22O2/c1-9(13(15)16)5-14-6-10-2-11(7-14)4-12(3-10)8-14;1-4-6-7-11(5-2)9-8-10(3)12(13)14/h5,10-12H,2-4,6-8H2,1H3,(H,15,16);8,11H,4-7,9H2,1-3H3,(H,13,14)/p-2/b9-5+;10-8-