4-chloranyl-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(4-methyl-3-nitro-phenyl)benzamide

Systemtic Name: 4-chloranyl-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(4-methyl-3-nitro-phenyl)benzamide Openeye Name: 4-chloro-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(4-methyl-3-nitro-phenyl)benzamide CAS Name: 4-chloro-3-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]-N-(4-methyl-3-nitrophenyl)benzamide IUPAC Name: 4-chloro-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(4-methyl-3-nitrophenyl)benzamide Traditional Name: 4-chloro-3-[(2S,6S)-2,6-dimethylmorpholino]sulfonyl-N-(4-methyl-3-nitro-phenyl)benzamide Formula: C20H22ClN3O6S MolecularWeight: 467.92318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C)[N+](=O)[O-])Cl

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H22ClN3O6S/c1-12-4-6-16(9-18(12)24(26)27)22-20(25)15-5-7-17(21)19(8-15)31(28,29)23-10-13(2)30-14(3)11-23/h4-9,13-14H,10-11H2,1-3H3,(H,22,25)/t13-,14-/m0/s1