3-(aminomethyl)-3,5,5-trimethyl-cyclohexan-1-amine; 2-azanylethanol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethyloxy)ethanol; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane; oxepan-2-one

Systemtic Name: 3-(aminomethyl)-3,5,5-trimethyl-cyclohexan-1-amine; 2-azanylethanol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethyloxy)ethanol; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane; oxepan-2-one Openeye Name: 2-aminoethanol; 3-(aminomethyl)-3,5,5-trimethyl-cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane; oxepan-2-one CAS Name: 2-aminoethanol; 3-(aminomethyl)-3,5,5-trimethyl-1-cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane; 2-oxepanone IUPAC Name: 2-aminoethanol; 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane; oxepan-2-one Traditional Name: 2-aminoethanol; [3-(aminomethyl)-3,5,5-trimethyl-cyclohexyl]amine; 2-ethyl-2-methylol-propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane; oxepan-2-one Formula: C43H85N5O11 MolecularWeight: 848.1619

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(CO)CO.CC1(CC(CC(C1)(C)CN)N)C.C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CO)N.C(COCCO)O

Isomeric SMILES

CCC(CO)(CO)CO.CC1(CC(CC(C1)(C)CN)N)C.C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CO)N.C(COCCO)O

InChI

InChI=1S/C15H22N2O2.C10H22N2.C6H14O3.C6H10O2.C4H10O3.C2H7NO/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19;1-9(2)4-8(12)5-10(3,6-9)7-11;1-2-6(3-7,4-8)5-9;7-6-4-2-1-3-5-8-6;5-1-3-7-4-2-6;3-1-2-4/h12-15H,1-9H2;8H,4-7,11-12H2,1-3H3;7-9H,2-5H2,1H3;1-5H2;5-6H,1-4H2;4H,1-3H2