1-nitro-4-pentylsulfanyl-benzene

Systemtic Name: 1-nitro-4-pentylsulfanyl-benzene Openeye Name: 1-nitro-4-pentylsulfanyl-benzene CAS Name: 1-nitro-4-(pentylthio)benzene IUPAC Name: 1-nitro-4-pentylsulfanylbenzene Traditional Name: 1-(amylthio)-4-nitro-benzene Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H15NO2S/c1-2-3-4-9-15-11-7-5-10(6-8-11)12(13)14/h5-8H,2-4,9H2,1H3