ethenoxyethene; N-[(5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl]carbamate

Systemtic Name: ethenoxyethene; N-[(5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl]carbamate Openeye Name: N-[(5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl]carbamate; vinyloxyethylene CAS Name: ethenoxyethene; N-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]carbamate IUPAC Name: ethenoxyethene; N-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]carbamate Traditional Name: N-[(5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl]carbamate; vinyloxyethylene Formula: C28H44N4O7-2 MolecularWeight: 548.67156

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)CNC(=O)[O-])N=C=O)C.CC1(CC(CC(C1)(C)CNC(=O)[O-])N=C=O)C.C=COC=C

Isomeric SMILES

CC1(CC(CC(C1)(C)CNC(=O)[O-])N=C=O)C.CC1(CC(CC(C1)(C)CNC(=O)[O-])N=C=O)C.C=COC=C

InChI

InChI=1S/2C12H20N2O3.C4H6O/c2*1-11(2)4-9(14-8-15)5-12(3,6-11)7-13-10(16)17;1-3-5-4-2/h2*9,13H,4-7H2,1-3H3,(H,16,17);3-4H,1-2H2/p-2