[2-(3-ethoxyphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-(3-ethoxyphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(3-ethoxyphenyl)-4-quinolyl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(3-ethoxyphenyl)-4-quinolinyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(3-ethoxyphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(2-m-phenetyl-4-quinolyl)methanone Formula: C24H28N3O2+ MolecularWeight: 390.49802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O2/c1-3-26-12-14-27(15-13-26)24(28)21-17-23(25-22-11-6-5-10-20(21)22)18-8-7-9-19(16-18)29-4-2/h5-11,16-17H,3-4,12-15H2,1-2H3/p+1