5-isocyanato-2-[(4-isocyanatocyclohexyl)methyl]-1,3-dimethyl-benzene

Systemtic Name: 5-isocyanato-2-[(4-isocyanatocyclohexyl)methyl]-1,3-dimethyl-benzene Openeye Name: 5-isocyanato-2-[(4-isocyanatocyclohexyl)methyl]-1,3-dimethyl-benzene CAS Name: 5-isocyanato-2-[(4-isocyanatocyclohexyl)methyl]-1,3-dimethylbenzene IUPAC Name: 5-isocyanato-2-[(4-isocyanatocyclohexyl)methyl]-1,3-dimethylbenzene Traditional Name: 5-isocyanato-2-[(4-isocyanatocyclohexyl)methyl]-1,3-dimethyl-benzene Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC2CCC(CC2)N=C=O)C)N=C=O

Isomeric SMILES

CC1=CC(=CC(=C1CC2CCC(CC2)N=C=O)C)N=C=O

InChI

InChI=1S/C17H20N2O2/c1-12-7-16(19-11-21)8-13(2)17(12)9-14-3-5-15(6-4-14)18-10-20/h7-8,14-15H,3-6,9H2,1-2H3