N-(2-ethyl-3-methyl-quinolin-4-yl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethyl-3-methyl-quinolin-4-yl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethyl-3-methyl-4-quinolyl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethyl-3-methyl-4-quinolinyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethyl-3-methylquinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethyl-3-methyl-4-quinolyl)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H27N4O3+ MolecularWeight: 407.48548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C23H26N4O3/c1-3-18-16(2)22(17-7-4-5-8-19(17)24-18)25-21(28)15-26-10-12-27(13-11-26)23(29)20-9-6-14-30-20/h4-9,14H,3,10-13,15H2,1-2H3,(H,24,25,28)/p+1