2-[4-(2,3-dihydro-1-benzofuran-5-ylcarbonyl)piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[4-(2,3-dihydro-1-benzofuran-5-ylcarbonyl)piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[4-(2,3-dihydrobenzofuran-5-carbonyl)piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[4-[2,3-dihydrobenzofuran-5-yl(oxo)methyl]-1-piperazin-1-iumyl]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[4-(2,3-dihydro-1-benzofuran-5-carbonyl)piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[4-(coumaran-5-carbonyl)piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide Formula: C19H23N4O4+ MolecularWeight: 371.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C19H22N4O4/c1-13-10-17(21-27-13)20-18(24)12-22-5-7-23(8-6-22)19(25)15-2-3-16-14(11-15)4-9-26-16/h2-3,10-11H,4-9,12H2,1H3,(H,20,21,24)/p+1