2-(azepan-1-ium-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-(4-morpholinosulfonylphenyl)acetamide Formula: C18H28N3O4S+ MolecularWeight: 382.49762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CCC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H27N3O4S/c22-18(15-20-9-3-1-2-4-10-20)19-16-5-7-17(8-6-16)26(23,24)21-11-13-25-14-12-21/h5-8H,1-4,9-15H2,(H,19,22)/p+1