N,N-diethyl-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidinyl]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidino]-3-nitro-benzenesulfonamide Formula: C18H25N5O5S MolecularWeight: 423.4866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC(C2)C3=NC(=NO3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC(C2)C3=NC(=NO3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O5S/c1-4-22(5-2)29(26,27)15-8-9-16(17(11-15)23(24)25)21-10-6-7-14(12-21)18-19-13(3)20-28-18/h8-9,11,14H,4-7,10,12H2,1-3H3