1-nitro-3-pent-1-ynyl-benzene

Systemtic Name: 1-nitro-3-pent-1-ynyl-benzene Openeye Name: 1-nitro-3-pent-1-ynyl-benzene CAS Name: 1-nitro-3-pent-1-ynylbenzene IUPAC Name: 1-nitro-3-pent-1-ynylbenzene Traditional Name: 1-nitro-3-pent-1-ynyl-benzene Formula: C11H11NO2 MolecularWeight: 189.21054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO2/c1-2-3-4-6-10-7-5-8-11(9-10)12(13)14/h5,7-9H,2-3H2,1H3