4-(3-chlorophenyl)-4-isocyanato-cyclohexan-1-one

Systemtic Name: 4-(3-chlorophenyl)-4-isocyanato-cyclohexan-1-one Openeye Name: 4-(3-chlorophenyl)-4-isocyanato-cyclohexanone CAS Name: 4-(3-chlorophenyl)-4-isocyanato-1-cyclohexanone IUPAC Name: 4-(3-chlorophenyl)-4-isocyanatocyclohexan-1-one Traditional Name: 4-(3-chlorophenyl)-4-isocyanato-cyclohexanone Formula: C13H12ClNO2 MolecularWeight: 249.69288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1=O)(C2=CC(=CC=C2)Cl)N=C=O

Isomeric SMILES

C1CC(CCC1=O)(C2=CC(=CC=C2)Cl)N=C=O

InChI

InChI=1S/C13H12ClNO2/c14-11-3-1-2-10(8-11)13(15-9-16)6-4-12(17)5-7-13/h1-3,8H,4-7H2