N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C18H27ClN3O4S+ MolecularWeight: 416.94268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C18H26ClN3O4S/c1-14-3-2-6-21(12-14)13-18(23)20-17-11-15(4-5-16(17)19)27(24,25)22-7-9-26-10-8-22/h4-5,11,14H,2-3,6-10,12-13H2,1H3,(H,20,23)/p+1/t14-/m0/s1