1-ethynyl-2-(2-methylprop-1-enyl)-4-nitro-benzene

Systemtic Name: 1-ethynyl-2-(2-methylprop-1-enyl)-4-nitro-benzene Openeye Name: 1-ethynyl-2-(2-methylprop-1-enyl)-4-nitro-benzene CAS Name: 1-ethynyl-2-(2-methylprop-1-enyl)-4-nitrobenzene IUPAC Name: 1-ethynyl-2-(2-methylprop-1-enyl)-4-nitrobenzene Traditional Name: 1-ethynyl-2-(2-methylprop-1-enyl)-4-nitro-benzene Formula: C12H11NO2 MolecularWeight: 201.22124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO2/c1-4-10-5-6-12(13(14)15)8-11(10)7-9(2)3/h1,5-8H,2-3H3