(2,6-dimethylquinolin-3-yl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (2,6-dimethylquinolin-3-yl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (2,6-dimethyl-3-quinolyl)-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (2,6-dimethyl-3-quinolinyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (2,6-dimethylquinolin-3-yl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (2,6-dimethyl-3-quinolyl)-[4-(3-fluoro-4-methoxy-benzyl)piperazin-4-ium-1-yl]methanone Formula: C24H27FN3O2+ MolecularWeight: 408.488483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)N3CC[NH+](CC3)CC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)N3CC[NH+](CC3)CC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C24H26FN3O2/c1-16-4-6-22-19(12-16)14-20(17(2)26-22)24(29)28-10-8-27(9-11-28)15-18-5-7-23(30-3)21(25)13-18/h4-7,12-14H,8-11,15H2,1-3H3/p+1