1-isocyanato-2-[(2-isocyanatocyclohexyl)methyl]-3-methyl-benzene

Systemtic Name: 1-isocyanato-2-[(2-isocyanatocyclohexyl)methyl]-3-methyl-benzene Openeye Name: 1-isocyanato-2-[(2-isocyanatocyclohexyl)methyl]-3-methyl-benzene CAS Name: 1-isocyanato-2-[(2-isocyanatocyclohexyl)methyl]-3-methylbenzene IUPAC Name: 1-isocyanato-2-[(2-isocyanatocyclohexyl)methyl]-3-methylbenzene Traditional Name: 1-isocyanato-2-[(2-isocyanatocyclohexyl)methyl]-3-methyl-benzene Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N=C=O)CC2CCCCC2N=C=O

Isomeric SMILES

CC1=C(C(=CC=C1)N=C=O)CC2CCCCC2N=C=O

InChI

InChI=1S/C16H18N2O2/c1-12-5-4-8-16(18-11-20)14(12)9-13-6-2-3-7-15(13)17-10-19/h4-5,8,13,15H,2-3,6-7,9H2,1H3