4-chloranyl-2-fluoranyl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-benzamide

Systemtic Name: 4-chloranyl-2-fluoranyl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-benzamide Openeye Name: 4-chloro-2-fluoro-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-benzamide CAS Name: 4-chloro-2-fluoro-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-phenethylbenzamide IUPAC Name: 4-chloro-2-fluoro-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethylbenzamide Traditional Name: 4-chloro-2-fluoro-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-benzamide Formula: C22H27ClFN2O+ MolecularWeight: 389.913983

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C22H26ClFN2O/c1-25-12-9-18(10-13-25)16-26(14-11-17-5-3-2-4-6-17)22(27)20-8-7-19(23)15-21(20)24/h2-8,15,18H,9-14,16H2,1H3/p+1