N-[1-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide

Systemtic Name: N-[1-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide Openeye Name: N-[1-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide CAS Name: N-[1-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-4-piperidin-1-iumyl]-2-methylbenzamide IUPAC Name: N-[1-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]piperidin-1-ium-4-yl]-2-methylbenzamide Traditional Name: N-[1-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide Formula: C22H27FN3O2+ MolecularWeight: 384.467083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O2/c1-16-4-2-3-5-20(16)22(28)25-19-10-12-26(13-11-19)15-21(27)24-14-17-6-8-18(23)9-7-17/h2-9,19H,10-15H2,1H3,(H,24,27)(H,25,28)/p+1