(2-methyl-2-adamantyl) 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enoic acid

Systemtic Name: (2-methyl-2-adamantyl) 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enoic acid Openeye Name: acrylic acid; (2-methyl-2-adamantyl) 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid (2-methyl-2-adamantyl) ester; 2-methyl-2-propenoic acid methyl ester; 2-propenoic acid IUPAC Name: (2-methyl-2-adamantyl) 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enoic acid Traditional Name: acrylic acid; 2-methylacrylic acid (2-methyl-2-adamantyl) ester; 2-methylacrylic acid methyl ester Formula: C23H34O6 MolecularWeight: 406.51246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OC.CC(=C)C(=O)OC1(C2CC3CC(C2)CC1C3)C.C=CC(=O)O

Isomeric SMILES

CC(=C)C(=O)OC.CC(=C)C(=O)OC1(C2CC3CC(C2)CC1C3)C.C=CC(=O)O

InChI

InChI=1S/C15H22O2.C5H8O2.C3H4O2/c1-9(2)14(16)17-15(3)12-5-10-4-11(7-12)8-13(15)6-10;1-4(2)5(6)7-3;1-2-3(4)5/h10-13H,1,4-8H2,2-3H3;1H2,2-3H3;2H,1H2,(H,4,5)