[2-(2,4-dimethoxyphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-(2,4-dimethoxyphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(2,4-dimethoxyphenyl)-4-quinolyl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(2,4-dimethoxyphenyl)-4-quinolinyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(2,4-dimethoxyphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [2-(2,4-dimethoxyphenyl)-4-quinolyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C24H27N3O3/c1-4-26-11-13-27(14-12-26)24(28)20-16-22(25-21-8-6-5-7-18(20)21)19-10-9-17(29-2)15-23(19)30-3/h5-10,15-16H,4,11-14H2,1-3H3/p+1