1-[(E)-4-chloranylbut-3-en-1-ynyl]-4-nitro-benzene

Systemtic Name: 1-[(E)-4-chloranylbut-3-en-1-ynyl]-4-nitro-benzene Openeye Name: 1-[(E)-4-chlorobut-3-en-1-ynyl]-4-nitro-benzene CAS Name: 1-[(E)-4-chlorobut-3-en-1-ynyl]-4-nitrobenzene IUPAC Name: 1-[(E)-4-chlorobut-3-en-1-ynyl]-4-nitrobenzene Traditional Name: 1-[(E)-4-chlorobut-3-en-1-ynyl]-4-nitro-benzene Formula: C10H6ClNO2 MolecularWeight: 207.61314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC=CCl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#C/C=C/Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H6ClNO2/c11-8-2-1-3-9-4-6-10(7-5-9)12(13)14/h2,4-8H/b8-2+