3-ethyl-2-methylidene-nonanoic acid; 2-methylidenedecanoic acid; 2-methylidenenonanoate; 2-methylidenetridecanoic acid; 11-methyl-2-methylidene-dodecanoic acid

Systemtic Name: 3-ethyl-2-methylidene-nonanoic acid; 2-methylidenedecanoic acid; 2-methylidenenonanoate; 2-methylidenetridecanoic acid; 11-methyl-2-methylidene-dodecanoic acid Openeye Name: 3-ethyl-2-methylene-nonanoic acid; 2-methylenedecanoic acid; 2-methylenenonanoate; 2-methylenetridecanoic acid; 11-methyl-2-methylene-dodecanoic acid CAS Name: 3-ethyl-2-methylenenonanoic acid; 2-methylenedecanoic acid; 2-methylenenonanoate; 2-methylenetridecanoic acid; 11-methyl-2-methylenedodecanoic acid IUPAC Name: 3-ethyl-2-methylidenenonanoic acid; 2-methylidenedecanoic acid; 2-methylidenenonanoate; 2-methylidenetridecanoic acid; 11-methyl-2-methylidenedodecanoic acid Traditional Name: 2-(1-ethylheptyl)acrylic acid; 2-heptylacrylate; 2-(9-methyldecyl)acrylic acid; 2-octylacrylic acid; 2-undecylacrylic acid Formula: C61H111O10- MolecularWeight: 1004.52804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=C)C(=O)O.CCCCCCCCC(=C)C(=O)O.CCCCCCCC(=C)C(=O)[O-].CCCCCCC(CC)C(=C)C(=O)O.CC(C)CCCCCCCCC(=C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=C)C(=O)O.CCCCCCCCC(=C)C(=O)O.CCCCCCCC(=C)C(=O)[O-].CCCCCCC(CC)C(=C)C(=O)O.CC(C)CCCCCCCCC(=C)C(=O)O

InChI

InChI=1S/2C14H26O2.C12H22O2.C11H20O2.C10H18O2/c1-12(2)10-8-6-4-5-7-9-11-13(3)14(15)16;1-3-4-5-6-7-8-9-10-11-12-13(2)14(15)16;1-4-6-7-8-9-11(5-2)10(3)12(13)14;1-3-4-5-6-7-8-9-10(2)11(12)13;1-3-4-5-6-7-8-9(2)10(11)12/h12H,3-11H2,1-2H3,(H,15,16);2-12H2,1H3,(H,15,16);11H,3-9H2,1-2H3,(H,13,14);2-9H2,1H3,(H,12,13);2-8H2,1H3,(H,11,12)/p-1