1-nitro-4-[(E)-pent-2-en-4-yn-2-yl]benzene

Systemtic Name: 1-nitro-4-[(E)-pent-2-en-4-yn-2-yl]benzene Openeye Name: 1-[(E)-1-methylbut-1-en-3-ynyl]-4-nitro-benzene CAS Name: 1-nitro-4-[(E)-pent-2-en-4-yn-2-yl]benzene IUPAC Name: 1-nitro-4-[(E)-pent-2-en-4-yn-2-yl]benzene Traditional Name: 1-[(E)-1-methylbut-1-en-3-ynyl]-4-nitro-benzene Formula: C11H9NO2 MolecularWeight: 187.19466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO2/c1-3-4-9(2)10-5-7-11(8-6-10)12(13)14/h1,4-8H,2H3/b9-4+