1-(3-nitro-4-phenylsulfanyl-phenyl)sulfonylpiperidine

Systemtic Name: 1-(3-nitro-4-phenylsulfanyl-phenyl)sulfonylpiperidine Openeye Name: 1-(3-nitro-4-phenylsulfanyl-phenyl)sulfonylpiperidine CAS Name: 1-[3-nitro-4-(phenylthio)phenyl]sulfonylpiperidine IUPAC Name: 1-(3-nitro-4-phenylsulfanylphenyl)sulfonylpiperidine Traditional Name: 1-[3-nitro-4-(phenylthio)phenyl]sulfonylpiperidine Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4S2/c20-19(21)16-13-15(25(22,23)18-11-5-2-6-12-18)9-10-17(16)24-14-7-3-1-4-8-14/h1,3-4,7-10,13H,2,5-6,11-12H2