2-(4-ethanoylpiperazin-1-ium-1-yl)-1-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)ethanone

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-1-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)ethanone Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)ethanone CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-1-(6-ethoxy-2,2,4-trimethyl-1-quinolinyl)ethanone IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-(6-ethoxy-2,2,4-trimethylquinolin-1-yl)ethanone Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)ethanone Formula: C22H32N3O3+ MolecularWeight: 386.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)C[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)C[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H31N3O3/c1-6-28-18-7-8-20-19(13-18)16(2)14-22(4,5)25(20)21(27)15-23-9-11-24(12-10-23)17(3)26/h7-8,13-14H,6,9-12,15H2,1-5H3/p+1