2-[4-(oxan-4-ylcarbonyl)piperazin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(oxan-4-ylcarbonyl)piperazin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: N-phenyl-2-[4-(tetrahydropyran-4-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[4-oxanyl(oxo)methyl]-1-piperazin-1-iumyl]-N-phenylacetamide IUPAC Name: 2-[4-(oxane-4-carbonyl)piperazin-1-ium-1-yl]-N-phenylacetamide Traditional Name: N-phenyl-2-[4-(tetrahydropyran-4-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1COCCC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H25N3O3/c22-17(19-16-4-2-1-3-5-16)14-20-8-10-21(11-9-20)18(23)15-6-12-24-13-7-15/h1-5,15H,6-14H2,(H,19,22)/p+1