N-(3-ethyl-2-propyl-quinolin-4-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-ethyl-2-propyl-quinolin-4-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(3-ethyl-2-propyl-4-quinolyl)-2-(4-methylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(3-ethyl-2-propyl-4-quinolinyl)-2-(4-methyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(3-ethyl-2-propylquinolin-4-yl)-2-(4-methylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(3-ethyl-2-propyl-4-quinolyl)-2-(4-methylpiperazin-1-ium-1-yl)acetamide Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1CC)NC(=O)C[NH+]3CCN(CC3)C

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1CC)NC(=O)C[NH+]3CCN(CC3)C

InChI

InChI=1S/C21H30N4O/c1-4-8-18-16(5-2)21(17-9-6-7-10-19(17)22-18)23-20(26)15-25-13-11-24(3)12-14-25/h6-7,9-10H,4-5,8,11-15H2,1-3H3,(H,22,23,26)/p+1