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

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(2-methylphenyl)quinolin-4-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(o-tolyl)-4-quinolyl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[2-(2-methylphenyl)-4-quinolinyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(2-methylphenyl)quinolin-4-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(o-tolyl)-4-quinolyl]methanone Formula: C23H26N3O+ MolecularWeight: 360.47204

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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=C4C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4C

InChI

InChI=1S/C23H25N3O/c1-3-25-12-14-26(15-13-25)23(27)20-16-22(18-9-5-4-8-17(18)2)24-21-11-7-6-10-19(20)21/h4-11,16H,3,12-15H2,1-2H3/p+1