2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(2S)-2-methyl-1-piperidin-1-iumyl]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C18H28N3O3S+ MolecularWeight: 366.49822

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H27N3O3S/c1-15-7-2-3-10-20(15)14-18(22)19-16-8-6-9-17(13-16)25(23,24)21-11-4-5-12-21/h6,8-9,13,15H,2-5,7,10-12,14H2,1H3,(H,19,22)/p+1/t15-/m0/s1