(2S,6S)-2,6-dimethyl-4-[2-(4-methylpiperidin-1-yl)-5-nitro-phenyl]sulfonyl-morpholine

Systemtic Name: (2S,6S)-2,6-dimethyl-4-[2-(4-methylpiperidin-1-yl)-5-nitro-phenyl]sulfonyl-morpholine Openeye Name: (2S,6S)-2,6-dimethyl-4-[2-(4-methyl-1-piperidyl)-5-nitro-phenyl]sulfonyl-morpholine CAS Name: (2S,6S)-2,6-dimethyl-4-[2-(4-methyl-1-piperidinyl)-5-nitrophenyl]sulfonylmorpholine IUPAC Name: (2S,6S)-2,6-dimethyl-4-[2-(4-methylpiperidin-1-yl)-5-nitrophenyl]sulfonylmorpholine Traditional Name: (2S,6S)-2,6-dimethyl-4-[2-(4-methylpiperidino)-5-nitro-phenyl]sulfonyl-morpholine Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CC(OC(C3)C)C

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC(CC3)C

InChI

InChI=1S/C18H27N3O5S/c1-13-6-8-19(9-7-13)17-5-4-16(21(22)23)10-18(17)27(24,25)20-11-14(2)26-15(3)12-20/h4-5,10,13-15H,6-9,11-12H2,1-3H3/t14-,15-/m0/s1