[(E)-2-nitrohept-1-enyl]sulfanylbenzene

Systemtic Name: [(E)-2-nitrohept-1-enyl]sulfanylbenzene Openeye Name: [(E)-2-nitrohept-1-enyl]sulfanylbenzene CAS Name: [[(E)-2-nitrohept-1-enyl]thio]benzene IUPAC Name: [(E)-2-nitrohept-1-enyl]sulfanylbenzene Traditional Name: [[(E)-2-nitrohept-1-enyl]thio]benzene Formula: C13H17NO2S MolecularWeight: 251.34458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CSC1=CC=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCC/C(=C\SC1=CC=CC=C1)/[N+](=O)[O-]

InChI

InChI=1S/C13H17NO2S/c1-2-3-5-8-12(14(15)16)11-17-13-9-6-4-7-10-13/h4,6-7,9-11H,2-3,5,8H2,1H3/b12-11+