1-[4-[2-(2,4-dimethylphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-2-morpholin-4-ium-4-yl-ethanone

Systemtic Name: 1-[4-[2-(2,4-dimethylphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-2-morpholin-4-ium-4-yl-ethanone Openeye Name: 1-[4-[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]piperazin-1-yl]-2-morpholin-4-ium-4-yl-ethanone CAS Name: 1-[4-[[2-(2,4-dimethylphenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]-2-(4-morpholin-4-iumyl)ethanone IUPAC Name: 1-[4-[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]piperazin-1-yl]-2-morpholin-4-ium-4-ylethanone Traditional Name: 1-[4-[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]piperazino]-2-morpholin-4-ium-4-yl-ethanone Formula: C28H33N4O3+ MolecularWeight: 473.58662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)C[NH+]5CCOCC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)C[NH+]5CCOCC5)C

InChI

InChI=1S/C28H32N4O3/c1-20-7-8-22(21(2)17-20)26-18-24(23-5-3-4-6-25(23)29-26)28(34)32-11-9-31(10-12-32)27(33)19-30-13-15-35-16-14-30/h3-8,17-18H,9-16,19H2,1-2H3/p+1