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

Systemtic Name: [4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-(2-fluoranyl-4-methoxy-phenyl)methanone Openeye Name: [4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-(2-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]-(2-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-(2-fluoro-4-methoxyphenyl)methanone Traditional Name: [4-(3-chlorobenzyl)piperazin-4-ium-1-yl]-(2-fluoro-4-methoxy-phenyl)methanone Formula: C19H21ClFN2O2+ MolecularWeight: 363.833643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)Cl)F

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)Cl)F

InChI

InChI=1S/C19H20ClFN2O2/c1-25-16-5-6-17(18(21)12-16)19(24)23-9-7-22(8-10-23)13-14-3-2-4-15(20)11-14/h2-6,11-12H,7-10,13H2,1H3/p+1