bis(oxiran-2-ylmethyl) cyclohexane-1,2-dicarboxylate; 1,6-diisocyanatohexane; prop-2-enoic acid

Systemtic Name: bis(oxiran-2-ylmethyl) cyclohexane-1,2-dicarboxylate; 1,6-diisocyanatohexane; prop-2-enoic acid Openeye Name: acrylic acid; bis(oxiran-2-ylmethyl) cyclohexane-1,2-dicarboxylate; 1,6-diisocyanatohexane CAS Name: cyclohexane-1,2-dicarboxylic acid bis(2-oxiranylmethyl) ester; 1,6-diisocyanatohexane; 2-propenoic acid IUPAC Name: bis(oxiran-2-ylmethyl) cyclohexane-1,2-dicarboxylate; 1,6-diisocyanatohexane; prop-2-enoic acid Traditional Name: acrylic acid; cyclohexane-1,2-dicarboxylic acid diglycidyl ester; 1,6-diisocyanatohexane Formula: C25H36N2O10 MolecularWeight: 524.56074

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)O.C1CCC(C(C1)C(=O)OCC2CO2)C(=O)OCC3CO3.C(CCCN=C=O)CCN=C=O

Isomeric SMILES

C=CC(=O)O.C1CCC(C(C1)C(=O)OCC2CO2)C(=O)OCC3CO3.C(CCCN=C=O)CCN=C=O

InChI

InChI=1S/C14H20O6.C8H12N2O2.C3H4O2/c15-13(19-7-9-5-17-9)11-3-1-2-4-12(11)14(16)20-8-10-6-18-10;11-7-9-5-3-1-2-4-6-10-8-12;1-2-3(4)5/h9-12H,1-8H2;1-6H2;2H,1H2,(H,4,5)