N-butyl-2-[4-[2-(2,4-dimethylquinolin-3-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[2-(2,4-dimethylquinolin-3-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[2-(2,4-dimethyl-3-quinolyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-butyl-2-[4-[2-(2,4-dimethyl-3-quinolinyl)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-2-[4-[2-(2,4-dimethylquinolin-3-yl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-butyl-2-[4-[2-(2,4-dimethyl-3-quinolyl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CCN(CC1)C(=O)CC2=C(C3=CC=CC=C3N=C2C)C

Isomeric SMILES

CCCCNC(=O)C[NH+]1CCN(CC1)C(=O)CC2=C(C3=CC=CC=C3N=C2C)C

InChI

InChI=1S/C23H32N4O2/c1-4-5-10-24-22(28)16-26-11-13-27(14-12-26)23(29)15-20-17(2)19-8-6-7-9-21(19)25-18(20)3/h6-9H,4-5,10-16H2,1-3H3,(H,24,28)/p+1