2-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[4-[(5-bromo-2-furanyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[4-(5-bromo-2-furoyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Formula: C19H23BrN3O3+ MolecularWeight: 421.30822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)Br

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C19H22BrN3O3/c1-2-14-5-3-4-6-15(14)21-18(24)13-22-9-11-23(12-10-22)19(25)16-7-8-17(20)26-16/h3-8H,2,9-13H2,1H3,(H,21,24)/p+1