(5-isocyanato-1,3,3-trimethyl-cyclohexyl)methylcarbamic acid

Systemtic Name: (5-isocyanato-1,3,3-trimethyl-cyclohexyl)methylcarbamic acid Openeye Name: (5-isocyanato-1,3,3-trimethyl-cyclohexyl)methylcarbamic acid CAS Name: (5-isocyanato-1,3,3-trimethylcyclohexyl)methylcarbamic acid IUPAC Name: (5-isocyanato-1,3,3-trimethylcyclohexyl)methylcarbamic acid Traditional Name: (5-isocyanato-1,3,3-trimethyl-cyclohexyl)methylcarbamic acid Formula: C12H20N2O3 MolecularWeight: 240.2988

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)CNC(=O)O)N=C=O)C

Isomeric SMILES

CC1(CC(CC(C1)(C)CNC(=O)O)N=C=O)C

InChI

InChI=1S/C12H20N2O3/c1-11(2)4-9(14-8-15)5-12(3,6-11)7-13-10(16)17/h9,13H,4-7H2,1-3H3,(H,16,17)