sodium 3-[1-(2-hydroxyethyloxy)-2-oxidanyl-ethyl]-2,2-diisocyanato-3,5,5-trimethyl-cyclohexan-1-one

Systemtic Name: sodium 3-[1-(2-hydroxyethyloxy)-2-oxidanyl-ethyl]-2,2-diisocyanato-3,5,5-trimethyl-cyclohexan-1-one Openeye Name: sodium 3-[2-hydroxy-1-(2-hydroxyethoxy)ethyl]-2,2-diisocyanato-3,5,5-trimethyl-cyclohexanone CAS Name: sodium 3-[2-hydroxy-1-(2-hydroxyethoxy)ethyl]-2,2-diisocyanato-3,5,5-trimethyl-1-cyclohexanone IUPAC Name: sodium 3-[2-hydroxy-1-(2-hydroxyethoxy)ethyl]-2,2-diisocyanato-3,5,5-trimethylcyclohexan-1-one Traditional Name: sodium 3-[2-hydroxy-1-(2-hydroxyethoxy)ethyl]-2,2-diisocyanato-3,5,5-trimethyl-cyclohexanone Formula: C15H22N2NaO6+ MolecularWeight: 349.33475

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(C1)(C)C(CO)OCCO)(N=C=O)N=C=O)C.[Na+]

Isomeric SMILES

CC1(CC(=O)C(C(C1)(C)C(CO)OCCO)(N=C=O)N=C=O)C.[Na+]

InChI

InChI=1S/C15H22N2O6.Na/c1-13(2)6-11(22)15(16-9-20,17-10-21)14(3,8-13)12(7-19)23-5-4-18;/h12,18-19H,4-8H2,1-3H3;/q;+1