3-ethyl-4-isocyanato-benzenecarbonitrile dichloride

Systemtic Name: 3-ethyl-4-isocyanato-benzenecarbonitrile dichloride Openeye Name: 3-ethyl-4-isocyanato-benzonitrile dichloride CAS Name: 3-ethyl-4-isocyanatobenzonitrile dichloride IUPAC Name: 3-ethyl-4-isocyanatobenzonitrile dichloride Traditional Name: 3-ethyl-4-isocyanato-benzonitrile dichloride Formula: C10H8Cl2N2O-2 MolecularWeight: 243.08932

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C#N)N=C=O.[Cl-].[Cl-]

Isomeric SMILES

CCC1=C(C=CC(=C1)C#N)N=C=O.[Cl-].[Cl-]

InChI

InChI=1S/C10H8N2O.2ClH/c1-2-9-5-8(6-11)3-4-10(9)12-7-13;;/h3-5H,2H2,1H3;2*1H/p-2