N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-fluoranyl-4-methyl-benzamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-fluoro-4-methyl-benzamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-3-fluoro-4-methylbenzamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-fluoro-4-methylbenzamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-3-fluoro-4-methyl-benzamide Formula: C20H23ClFN2O+ MolecularWeight: 361.860823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C20H22ClFN2O/c1-14-2-5-16(12-19(14)22)20(25)23-18-8-10-24(11-9-18)13-15-3-6-17(21)7-4-15/h2-7,12,18H,8-11,13H2,1H3,(H,23,25)/p+1