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

Systemtic Name: 3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(2-ethyl-6-methyl-phenyl)benzamide Openeye Name: 3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(2-ethyl-6-methyl-phenyl)benzamide CAS Name: 3-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]-N-(2-ethyl-6-methylphenyl)benzamide IUPAC Name: 3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(2-ethyl-6-methylphenyl)benzamide Traditional Name: 3-[(2S,6S)-2,6-dimethylmorpholino]sulfonyl-N-(2-ethyl-6-methyl-phenyl)benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CC(OC(C3)C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3C[C@@H](O[C@H](C3)C)C)C

InChI

InChI=1S/C22H28N2O4S/c1-5-18-9-6-8-15(2)21(18)23-22(25)19-10-7-11-20(12-19)29(26,27)24-13-16(3)28-17(4)14-24/h6-12,16-17H,5,13-14H2,1-4H3,(H,23,25)/t16-,17-/m0/s1