1-chloranyl-2-ethynyl-3-nitro-benzene

Systemtic Name: 1-chloranyl-2-ethynyl-3-nitro-benzene Openeye Name: 1-chloro-2-ethynyl-3-nitro-benzene CAS Name: 1-chloro-2-ethynyl-3-nitrobenzene IUPAC Name: 1-chloro-2-ethynyl-3-nitrobenzene Traditional Name: 1-chloro-2-ethynyl-3-nitro-benzene Formula: C8H4ClNO2 MolecularWeight: 181.57586

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C=CC=C1Cl)[N+](=O)[O-]

Isomeric SMILES

C#CC1=C(C=CC=C1Cl)[N+](=O)[O-]

InChI

InChI=1S/C8H4ClNO2/c1-2-6-7(9)4-3-5-8(6)10(11)12/h1,3-5H