[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(4-propoxyphenyl)methanone

Systemtic Name: [4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(4-propoxyphenyl)methanone Openeye Name: [4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(4-propoxyphenyl)methanone CAS Name: [4-[(3-fluorophenyl)methyl]-1-piperazin-4-iumyl]-(4-propoxyphenyl)methanone IUPAC Name: [4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(4-propoxyphenyl)methanone Traditional Name: [4-(3-fluorobenzyl)piperazin-4-ium-1-yl]-(4-propoxyphenyl)methanone Formula: C21H26FN2O2+ MolecularWeight: 357.441743

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)F

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H25FN2O2/c1-2-14-26-20-8-6-18(7-9-20)21(25)24-12-10-23(11-13-24)16-17-4-3-5-19(22)15-17/h3-9,15H,2,10-14,16H2,1H3/p+1