3-fluoranyl-4-methoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-fluoranyl-4-methoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-fluoro-4-methoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-fluoro-4-methoxy-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-fluoro-4-methoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-fluoro-4-methoxy-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C21H26FN2O2+ MolecularWeight: 357.441743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3)F

InChI

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