N-(2-cyclopentylsulfanylethyl)-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-(2-cyclopentylsulfanylethyl)-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: N-(2-cyclopentylsulfanylethyl)-2-methoxy-5-nitro-benzenesulfonamide CAS Name: N-[2-(cyclopentylthio)ethyl]-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-(2-cyclopentylsulfanylethyl)-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: N-[2-(cyclopentylthio)ethyl]-2-methoxy-5-nitro-benzenesulfonamide Formula: C14H20N2O5S2 MolecularWeight: 360.449

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCSC2CCCC2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCSC2CCCC2

InChI

InChI=1S/C14H20N2O5S2/c1-21-13-7-6-11(16(17)18)10-14(13)23(19,20)15-8-9-22-12-4-2-3-5-12/h6-7,10,12,15H,2-5,8-9H2,1H3