(E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one

Systemtic Name: (E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one Openeye Name: (E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one CAS Name: (E)-1-(4-nitrophenyl)-3-pent-1-en-4-ynone IUPAC Name: (E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one Traditional Name: (E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one Formula: C11H7NO3 MolecularWeight: 201.17818

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H7NO3/c1-2-11(13)8-5-9-3-6-10(7-4-9)12(14)15/h1,3-8H/b8-5+