2-ethylhexyl 2-methylprop-2-enoate; 2-methylidenebutanedioic acid

Systemtic Name: 2-ethylhexyl 2-methylprop-2-enoate; 2-methylidenebutanedioic acid Openeye Name: 2-ethylhexyl 2-methylprop-2-enoate; 2-methylenebutanedioic acid CAS Name: 2-methylenebutanedioic acid; 2-methyl-2-propenoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 2-methylprop-2-enoate; 2-methylidenebutanedioic acid Traditional Name: itaconic acid; 2-methylacrylic acid 2-ethylhexyl ester Formula: C17H28O6 MolecularWeight: 328.40062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O2.C5H6O4/c1-5-7-8-11(6-2)9-14-12(13)10(3)4;1-3(5(8)9)2-4(6)7/h11H,3,5-9H2,1-2,4H3;1-2H2,(H,6,7)(H,8,9)