[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-[(2S)-2-methylmorpholin-4-yl]methanone

Systemtic Name: [3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-[(2S)-2-methylmorpholin-4-yl]methanone Openeye Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-[(2S)-2-methylmorpholin-4-yl]methanone CAS Name: [3-(1-azepanylsulfonyl)-4-chlorophenyl]-[(2S)-2-methyl-4-morpholinyl]methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)-4-chlorophenyl]-[(2S)-2-methylmorpholin-4-yl]methanone Traditional Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-[(2S)-2-methylmorpholino]methanone Formula: C18H25ClN2O4S MolecularWeight: 400.9201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

C[C@H]1CN(CCO1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H25ClN2O4S/c1-14-13-20(10-11-25-14)18(22)15-6-7-16(19)17(12-15)26(23,24)21-8-4-2-3-5-9-21/h6-7,12,14H,2-5,8-11,13H2,1H3/t14-/m0/s1