2-nitrohept-1-en-3-ylbenzene

Systemtic Name: 2-nitrohept-1-en-3-ylbenzene Openeye Name: 1-(1-nitrovinyl)pentylbenzene CAS Name: 2-nitrohept-1-en-3-ylbenzene IUPAC Name: 2-nitrohept-1-en-3-ylbenzene Traditional Name: (1-butyl-2-nitro-allyl)benzene Formula: C13H17NO2 MolecularWeight: 219.27958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO2/c1-3-4-10-13(11(2)14(15)16)12-8-6-5-7-9-12/h5-9,13H,2-4,10H2,1H3