N4,N4-dimethyl-2-nitro-N1-[2-(4-piperidin-1-ylphenyl)ethyl]benzene-1,4-disulfonamide

Systemtic Name: N4,N4-dimethyl-2-nitro-N1-[2-(4-piperidin-1-ylphenyl)ethyl]benzene-1,4-disulfonamide Openeye Name: N4,N4-dimethyl-2-nitro-N1-[2-[4-(1-piperidyl)phenyl]ethyl]benzene-1,4-disulfonamide CAS Name: N4,N4-dimethyl-2-nitro-N1-[2-[4-(1-piperidinyl)phenyl]ethyl]benzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-dimethyl-2-nitro-1-N-[2-(4-piperidin-1-ylphenyl)ethyl]benzene-1,4-disulfonamide Traditional Name: N',N'-dimethyl-2-nitro-N-[2-(4-piperidinophenyl)ethyl]benzene-1,4-disulfonamide Formula: C21H28N4O6S2 MolecularWeight: 496.60022

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O6S2/c1-23(2)33(30,31)19-10-11-21(20(16-19)25(26)27)32(28,29)22-13-12-17-6-8-18(9-7-17)24-14-4-3-5-15-24/h6-11,16,22H,3-5,12-15H2,1-2H3