1-(4-fluorophenyl)-4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(4-fluorophenyl)-4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium Openeye Name: 1-(4-fluorophenyl)-4-[(4-isopropylphenyl)methyl]piperazin-4-ium CAS Name: 1-(4-fluorophenyl)-4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(4-fluorophenyl)-4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-fluorophenyl)-4-(4-isopropylbenzyl)piperazin-4-ium Formula: C20H26FN2+ MolecularWeight: 313.432243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25FN2/c1-16(2)18-5-3-17(4-6-18)15-22-11-13-23(14-12-22)20-9-7-19(21)8-10-20/h3-10,16H,11-15H2,1-2H3/p+1