1-nitro-2-[(E)-4-phenylbut-1-en-3-ynyl]benzene

Systemtic Name: 1-nitro-2-[(E)-4-phenylbut-1-en-3-ynyl]benzene Openeye Name: 1-nitro-2-[(E)-4-phenylbut-1-en-3-ynyl]benzene CAS Name: 1-nitro-2-[(E)-4-phenylbut-1-en-3-ynyl]benzene IUPAC Name: 1-nitro-2-[(E)-4-phenylbut-1-en-3-ynyl]benzene Traditional Name: 1-nitro-2-[(E)-4-phenylbut-1-en-3-ynyl]benzene Formula: C16H11NO2 MolecularWeight: 249.26404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#C/C=C/C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H11NO2/c18-17(19)16-13-7-6-12-15(16)11-5-4-10-14-8-2-1-3-9-14/h1-3,5-9,11-13H/b11-5+