(5R)-1-[(3-chlorophenyl)methyl]-5-thiomorpholin-4-ium-4-yl-azepan-2-one

Systemtic Name: (5R)-1-[(3-chlorophenyl)methyl]-5-thiomorpholin-4-ium-4-yl-azepan-2-one Openeye Name: (5R)-1-[(3-chlorophenyl)methyl]-5-thiomorpholin-4-ium-4-yl-azepan-2-one CAS Name: (5R)-1-[(3-chlorophenyl)methyl]-5-(4-thiomorpholin-4-iumyl)-2-azepanone IUPAC Name: (5R)-1-[(3-chlorophenyl)methyl]-5-thiomorpholin-4-ium-4-ylazepan-2-one Traditional Name: (5R)-1-(3-chlorobenzyl)-5-thiomorpholin-4-ium-4-yl-azepan-2-one Formula: C17H24ClN2OS+ MolecularWeight: 339.90326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CCC1[NH+]2CCSCC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CC(=O)N(CC[C@@H]1[NH+]2CCSCC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H23ClN2OS/c18-15-3-1-2-14(12-15)13-20-7-6-16(4-5-17(20)21)19-8-10-22-11-9-19/h1-3,12,16H,4-11,13H2/p+1/t16-/m1/s1