3-azanylcyclohexan-1-ol; 2-hydroxyethyl prop-2-enoate; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane

Systemtic Name: 3-azanylcyclohexan-1-ol; 2-hydroxyethyl prop-2-enoate; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane Openeye Name: 3-aminocyclohexanol; 2-hydroxyethyl prop-2-enoate; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane CAS Name: 3-amino-1-cyclohexanol; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane; 2-propenoic acid 2-hydroxyethyl ester IUPAC Name: 3-aminocyclohexan-1-ol; 2-hydroxyethyl prop-2-enoate; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane Traditional Name: acrylic acid 2-hydroxyethyl ester; 3-aminocyclohexanol; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane Formula: C23H39N3O6 MolecularWeight: 453.57226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C=CC(=O)OCCO.C1CC(CC(C1)O)N

Isomeric SMILES

CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C=CC(=O)OCCO.C1CC(CC(C1)O)N

InChI

InChI=1S/C12H18N2O2.C6H13NO.C5H8O3/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15;7-5-2-1-3-6(8)4-5;1-2-5(7)8-4-3-6/h10H,4-7H2,1-3H3;5-6,8H,1-4,7H2;2,6H,1,3-4H2