1-chloranyl-3-nitro-2-(2-phenylethynyl)benzene

Systemtic Name: 1-chloranyl-3-nitro-2-(2-phenylethynyl)benzene Openeye Name: 1-chloro-3-nitro-2-(2-phenylethynyl)benzene CAS Name: 1-chloro-3-nitro-2-(2-phenylethynyl)benzene IUPAC Name: 1-chloro-3-nitro-2-(2-phenylethynyl)benzene Traditional Name: 1-chloro-3-nitro-2-(2-phenylethynyl)benzene Formula: C14H8ClNO2 MolecularWeight: 257.67182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(C=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(C=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H8ClNO2/c15-13-7-4-8-14(16(17)18)12(13)10-9-11-5-2-1-3-6-11/h1-8H