azepan-1-yl-[4-chloranyl-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-phenyl]methanone

Systemtic Name: azepan-1-yl-[4-chloranyl-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-phenyl]methanone Openeye Name: azepan-1-yl-[4-chloro-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-phenyl]methanone CAS Name: 1-azepanyl-[4-chloro-3-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]phenyl]methanone IUPAC Name: azepan-1-yl-[4-chloro-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]methanone Traditional Name: azepan-1-yl-[4-chloro-3-[(2S,6S)-2,6-dimethylmorpholino]sulfonyl-phenyl]methanone Formula: C19H27ClN2O4S MolecularWeight: 414.94668

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)Cl

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C19H27ClN2O4S/c1-14-12-22(13-15(2)26-14)27(24,25)18-11-16(7-8-17(18)20)19(23)21-9-5-3-4-6-10-21/h7-8,11,14-15H,3-6,9-10,12-13H2,1-2H3/t14-,15-/m0/s1