2-[4-(2-morpholin-4-ylethanoyl)piperazin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[4-(2-morpholin-4-ylethanoyl)piperazin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-(2-morpholinoacetyl)piperazin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-[2-(4-morpholinyl)-1-oxoethyl]-1-piperazin-1-iumyl]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[4-(2-morpholin-4-ylacetyl)piperazin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[4-(2-morpholinoacetyl)piperazin-1-ium-1-yl]acetamide Formula: C21H33N4O3+ MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)CN3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)CN3CCOCC3)C

InChI

InChI=1S/C21H32N4O3/c1-16-12-17(2)21(18(3)13-16)22-19(26)14-23-4-6-25(7-5-23)20(27)15-24-8-10-28-11-9-24/h12-13H,4-11,14-15H2,1-3H3,(H,22,26)/p+1