N-(2-ethylphenyl)-4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2-ethylphenyl)-4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(2-ethylphenyl)-4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-(2-ethylphenyl)-4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2-ethylphenyl)-4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(2-ethylphenyl)-4-(4-fluorobenzyl)piperazin-4-ium-1-carboxamide Formula: C20H25FN3O+ MolecularWeight: 342.430403

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H24FN3O/c1-2-17-5-3-4-6-19(17)22-20(25)24-13-11-23(12-14-24)15-16-7-9-18(21)10-8-16/h3-10H,2,11-15H2,1H3,(H,22,25)/p+1