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

Systemtic Name: N-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]carbonylphenyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[4-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[4-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]-oxomethyl]phenyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[4-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[4-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6S/c1-13-4-9-18(10-19(13)23(25)26)30(27,28)21-17-7-5-16(6-8-17)20(24)22-11-14(2)29-15(3)12-22/h4-10,14-15,21H,11-12H2,1-3H3/t14-,15-/m0/s1