4-(4-isocyanatobutan-2-yl)-1-isocyano-1-methyl-cyclohexane

Systemtic Name: 4-(4-isocyanatobutan-2-yl)-1-isocyano-1-methyl-cyclohexane Openeye Name: 4-(3-isocyanato-1-methyl-propyl)-1-isocyano-1-methyl-cyclohexane CAS Name: 4-(4-isocyanatobutan-2-yl)-1-isocyano-1-methylcyclohexane IUPAC Name: 4-(4-isocyanatobutan-2-yl)-1-isocyano-1-methylcyclohexane Traditional Name: 4-(3-isocyanato-1-methyl-propyl)-1-isocyano-1-methyl-cyclohexane Formula: C13H20N2O MolecularWeight: 220.3107

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN=C=O)C1CCC(CC1)(C)[N+]#[C-]

Isomeric SMILES

CC(CCN=C=O)C1CCC(CC1)(C)[N+]#[C-]

InChI

InChI=1S/C13H20N2O/c1-11(6-9-15-10-16)12-4-7-13(2,14-3)8-5-12/h11-12H,4-9H2,1-2H3