1-nitro-4-(4-phenylmethoxybutylsulfanyl)benzene

Systemtic Name: 1-nitro-4-(4-phenylmethoxybutylsulfanyl)benzene Openeye Name: 1-(4-benzyloxybutylsulfanyl)-4-nitro-benzene CAS Name: 1-nitro-4-(4-phenylmethoxybutylthio)benzene IUPAC Name: 1-nitro-4-(4-phenylmethoxybutylsulfanyl)benzene Traditional Name: 1-(4-benzoxybutylthio)-4-nitro-benzene Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCCSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COCCCCSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19NO3S/c19-18(20)16-8-10-17(11-9-16)22-13-5-4-12-21-14-15-6-2-1-3-7-15/h1-3,6-11H,4-5,12-14H2