butyl 2-methylprop-2-enoate; 4-ethyl-2-methylidene-octanoic acid; prop-2-enoic acid

Systemtic Name: butyl 2-methylprop-2-enoate; 4-ethyl-2-methylidene-octanoic acid; prop-2-enoic acid Openeye Name: acrylic acid; butyl 2-methylprop-2-enoate; 4-ethyl-2-methylene-octanoic acid CAS Name: 4-ethyl-2-methyleneoctanoic acid; 2-methyl-2-propenoic acid butyl ester; 2-propenoic acid IUPAC Name: butyl 2-methylprop-2-enoate; 4-ethyl-2-methylideneoctanoic acid; prop-2-enoic acid Traditional Name: acrylic acid; 2-(2-ethylhexyl)acrylic acid; 2-methylacrylic acid butyl ester Formula: C22H38O6 MolecularWeight: 398.53352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(=C)C(=O)O.CCCCOC(=O)C(=C)C.C=CC(=O)O

Isomeric SMILES

CCCCC(CC)CC(=C)C(=O)O.CCCCOC(=O)C(=C)C.C=CC(=O)O

InChI

InChI=1S/C11H20O2.C8H14O2.C3H4O2/c1-4-6-7-10(5-2)8-9(3)11(12)13;1-4-5-6-10-8(9)7(2)3;1-2-3(4)5/h10H,3-8H2,1-2H3,(H,12,13);2,4-6H2,1,3H3;2H,1H2,(H,4,5)