2-(butylsulfanylmethyl)-1-chloranyl-4-nitro-benzene

Systemtic Name: 2-(butylsulfanylmethyl)-1-chloranyl-4-nitro-benzene Openeye Name: 2-(butylsulfanylmethyl)-1-chloro-4-nitro-benzene CAS Name: 2-[(butylthio)methyl]-1-chloro-4-nitrobenzene IUPAC Name: 2-(butylsulfanylmethyl)-1-chloro-4-nitrobenzene Traditional Name: 2-[(butylthio)methyl]-1-chloro-4-nitro-benzene Formula: C11H14ClNO2S MolecularWeight: 259.75236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCSCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H14ClNO2S/c1-2-3-6-16-8-9-7-10(13(14)15)4-5-11(9)12/h4-5,7H,2-3,6,8H2,1H3