1,3,5-triisocyanato-6-methyl-cyclohexa-1,3-diene

Systemtic Name: 1,3,5-triisocyanato-6-methyl-cyclohexa-1,3-diene Openeye Name: 1,3,5-triisocyanato-6-methyl-cyclohexa-1,3-diene CAS Name: 1,3,5-triisocyanato-6-methylcyclohexa-1,3-diene IUPAC Name: 1,3,5-triisocyanato-6-methylcyclohexa-1,3-diene Traditional Name: 1,3,5-triisocyanato-6-methyl-cyclohexa-1,3-diene Formula: C10H7N3O3 MolecularWeight: 217.18088

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C=C(C=C1N=C=O)N=C=O)N=C=O

Isomeric SMILES

CC1C(C=C(C=C1N=C=O)N=C=O)N=C=O

InChI

InChI=1S/C10H7N3O3/c1-7-9(12-5-15)2-8(11-4-14)3-10(7)13-6-16/h2-3,7,9H,1H3