ethene; 4-isocyanato-4-(2-methylphenyl)cyclohexan-1-one

Systemtic Name: ethene; 4-isocyanato-4-(2-methylphenyl)cyclohexan-1-one Openeye Name: ethylene; 4-isocyanato-4-(o-tolyl)cyclohexanone CAS Name: ethene; 4-isocyanato-4-(2-methylphenyl)-1-cyclohexanone IUPAC Name: ethene; 4-isocyanato-4-(2-methylphenyl)cyclohexan-1-one Traditional Name: ethylene; 4-isocyanato-4-(o-tolyl)cyclohexanone Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2(CCC(=O)CC2)N=C=O.C=C

Isomeric SMILES

CC1=CC=CC=C1C2(CCC(=O)CC2)N=C=O.C=C

InChI

InChI=1S/C14H15NO2.C2H4/c1-11-4-2-3-5-13(11)14(15-10-16)8-6-12(17)7-9-14;1-2/h2-5H,6-9H2,1H3;1-2H2