3,4,5-triisocyanato-2-methyl-benzoate

Systemtic Name: 3,4,5-triisocyanato-2-methyl-benzoate Openeye Name: 3,4,5-triisocyanato-2-methyl-benzoate CAS Name: 3,4,5-triisocyanato-2-methylbenzoate IUPAC Name: 3,4,5-triisocyanato-2-methylbenzoate Traditional Name: 3,4,5-triisocyanato-2-methyl-benzoate Formula: C11H4N3O5- MolecularWeight: 258.16656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)[O-])N=C=O)N=C=O)N=C=O

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)[O-])N=C=O)N=C=O)N=C=O

InChI

InChI=1S/C11H5N3O5/c1-6-7(11(18)19)2-8(12-3-15)10(14-5-17)9(6)13-4-16/h2H,1H3,(H,18,19)/p-1