N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-methoxy-2-nitro-benzenesulfonamide

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-methoxy-2-nitro-benzenesulfonamide Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-4-methoxy-2-nitro-benzenesulfonamide CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-4-methoxy-2-nitrobenzenesulfonamide IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-methoxy-2-nitrobenzenesulfonamide Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-4-methoxy-2-nitro-benzenesulfonamide Formula: C20H25N3O7S2 MolecularWeight: 483.5584

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C20H25N3O7S2/c1-14-5-4-6-15(2)22(14)32(28,29)18-10-7-16(8-11-18)21-31(26,27)20-12-9-17(30-3)13-19(20)23(24)25/h7-15,21H,4-6H2,1-3H3