4-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methyl-propyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methyl-propyl]amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methyl-propyl]amino]-3-nitro-benzenesulfonamide CAS Name: 4-[[2-[(2S,6S)-2,6-dimethyl-4-morpholinyl]-2-methylpropyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropyl]amino]-3-nitrobenzenesulfonamide Traditional Name: 4-[[2-[(2S,6S)-2,6-dimethylmorpholino]-2-methyl-propyl]amino]-3-nitro-benzenesulfonamide Formula: C16H26N4O5S MolecularWeight: 386.46644

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(C)(C)CNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(C)(C)CNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H26N4O5S/c1-11-8-19(9-12(2)25-11)16(3,4)10-18-14-6-5-13(26(17,23)24)7-15(14)20(21)22/h5-7,11-12,18H,8-10H2,1-4H3,(H2,17,23,24)/t11-,12-/m0/s1