2-[bis(chloranyl)methyl]-1-chloranyl-3-isocyanato-benzene

Systemtic Name: 2-[bis(chloranyl)methyl]-1-chloranyl-3-isocyanato-benzene Openeye Name: 1-chloro-2-(dichloromethyl)-3-isocyanato-benzene CAS Name: 1-chloro-2-(dichloromethyl)-3-isocyanatobenzene IUPAC Name: 1-chloro-2-(dichloromethyl)-3-isocyanatobenzene Traditional Name: 1-chloro-2-(dichloromethyl)-3-isocyanato-benzene Formula: C8H4Cl3NO MolecularWeight: 236.48246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C(Cl)Cl)N=C=O

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C(Cl)Cl)N=C=O

InChI

InChI=1S/C8H4Cl3NO/c9-5-2-1-3-6(12-4-13)7(5)8(10)11/h1-3,8H