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

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-fluoro-4-methoxy-phenyl)-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-fluoro-4-methoxyphenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-fluoro-4-methoxyphenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: [4-(3-fluoro-4-methoxy-benzyl)piperazin-4-ium-1-yl]-(3-fluoro-4-methoxy-phenyl)methanone Formula: C20H23F2N2O3+ MolecularWeight: 377.405026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F)F

InChI

InChI=1S/C20H22F2N2O3/c1-26-18-5-3-14(11-16(18)21)13-23-7-9-24(10-8-23)20(25)15-4-6-19(27-2)17(22)12-15/h3-6,11-12H,7-10,13H2,1-2H3/p+1