2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidin-1-iumyl]-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(4-morpholinosulfonylphenyl)acetamide Formula: C24H37N4O5S+ MolecularWeight: 493.63938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H36N4O5S/c29-23(19-26-13-9-20(10-14-26)24(30)27-11-3-1-2-4-12-27)25-21-5-7-22(8-6-21)34(31,32)28-15-17-33-18-16-28/h5-8,20H,1-4,9-19H2,(H,25,29)/p+1