4-bromanyl-1-isocyanato-2-(2-phenylethynyl)benzene

Systemtic Name: 4-bromanyl-1-isocyanato-2-(2-phenylethynyl)benzene Openeye Name: 4-bromo-1-isocyanato-2-(2-phenylethynyl)benzene CAS Name: 4-bromo-1-isocyanato-2-(2-phenylethynyl)benzene IUPAC Name: 4-bromo-1-isocyanato-2-(2-phenylethynyl)benzene Traditional Name: 4-bromo-1-isocyanato-2-(2-phenylethynyl)benzene Formula: C15H8BrNO MolecularWeight: 298.13412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(C=CC(=C2)Br)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(C=CC(=C2)Br)N=C=O

InChI

InChI=1S/C15H8BrNO/c16-14-8-9-15(17-11-18)13(10-14)7-6-12-4-2-1-3-5-12/h1-5,8-10H