1-nitro-4-(9-phenylsulfanylnonyl)benzene

Systemtic Name: 1-nitro-4-(9-phenylsulfanylnonyl)benzene Openeye Name: 1-nitro-4-(9-phenylsulfanylnonyl)benzene CAS Name: 1-nitro-4-[9-(phenylthio)nonyl]benzene IUPAC Name: 1-nitro-4-(9-phenylsulfanylnonyl)benzene Traditional Name: 1-nitro-4-[9-(phenylthio)nonyl]benzene Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCCCCCCCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCCCCCCCCCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H27NO2S/c23-22(24)20-16-14-19(15-17-20)11-7-4-2-1-3-5-10-18-25-21-12-8-6-9-13-21/h6,8-9,12-17H,1-5,7,10-11,18H2