2,4-diisocyanato-1-methyl-benzene; hexane

Systemtic Name: 2,4-diisocyanato-1-methyl-benzene; hexane Openeye Name: 2,4-diisocyanato-1-methyl-benzene; hexane CAS Name: 2,4-diisocyanato-1-methylbenzene; hexane IUPAC Name: 2,4-diisocyanato-1-methylbenzene; hexane Traditional Name: 2,4-diisocyanato-1-methyl-benzene; n-hexane Formula: C15H20N2O2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CC1=C(C=C(C=C1)N=C=O)N=C=O

Isomeric SMILES

CCCCCC.CC1=C(C=C(C=C1)N=C=O)N=C=O

InChI

InChI=1S/C9H6N2O2.C6H14/c1-7-2-3-8(10-5-12)4-9(7)11-6-13;1-3-5-6-4-2/h2-4H,1H3;3-6H2,1-2H3