butyl prop-2-enoate; 4-methyl-2-methylidene-pentanoic acid; prop-2-enoic acid

Systemtic Name: butyl prop-2-enoate; 4-methyl-2-methylidene-pentanoic acid; prop-2-enoic acid Openeye Name: acrylic acid; butyl prop-2-enoate; 4-methyl-2-methylene-pentanoic acid CAS Name: 4-methyl-2-methylenepentanoic acid; 2-propenoic acid; 2-propenoic acid butyl ester IUPAC Name: butyl prop-2-enoate; 4-methyl-2-methylidenepentanoic acid; prop-2-enoic acid Traditional Name: acrylic acid; acrylic acid butyl ester; 2-isobutylacrylic acid Formula: C17H28O6 MolecularWeight: 328.40062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H12O2.C3H4O2/c1-5(2)4-6(3)7(8)9;1-3-5-6-9-7(8)4-2;1-2-3(4)5/h5H,3-4H2,1-2H3,(H,8,9);4H,2-3,5-6H2,1H3;2H,1H2,(H,4,5)