1-(3-methylbut-3-en-1-ynyl)-4-nitro-benzene

Systemtic Name: 1-(3-methylbut-3-en-1-ynyl)-4-nitro-benzene Openeye Name: 1-(3-methylbut-3-en-1-ynyl)-4-nitro-benzene CAS Name: 1-(3-methylbut-3-en-1-ynyl)-4-nitrobenzene IUPAC Name: 1-(3-methylbut-3-en-1-ynyl)-4-nitrobenzene Traditional Name: 1-(3-methylbut-3-en-1-ynyl)-4-nitro-benzene Formula: C11H9NO2 MolecularWeight: 187.19466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO2/c1-9(2)3-4-10-5-7-11(8-6-10)12(13)14/h5-8H,1H2,2H3