(3-fluoranyl-4-methyl-phenyl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-fluoranyl-4-methyl-phenyl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-fluoro-4-methyl-phenyl)-[4-(m-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3-fluoro-4-methylphenyl)-[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-fluoro-4-methylphenyl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-fluoro-4-methyl-phenyl)-[4-(3-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C20H24FN2O+ MolecularWeight: 327.415763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)F

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)F

InChI

InChI=1S/C20H23FN2O/c1-15-4-3-5-17(12-15)14-22-8-10-23(11-9-22)20(24)18-7-6-16(2)19(21)13-18/h3-7,12-13H,8-11,14H2,1-2H3/p+1