N-[1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-fluoranyl-benzamide Openeye Name: N-[1-[2-(4-chloroanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-2-fluoro-benzamide CAS Name: N-[1-[2-(4-chloroanilino)-2-oxoethyl]-4-piperidin-1-iumyl]-2-fluorobenzamide IUPAC Name: N-[1-[2-(4-chloroanilino)-2-oxoethyl]piperidin-1-ium-4-yl]-2-fluorobenzamide Traditional Name: N-[1-[2-(4-chloroanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]-2-fluoro-benzamide Formula: C20H22ClFN3O2+ MolecularWeight: 390.858983

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2F)CC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2F)CC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClFN3O2/c21-14-5-7-15(8-6-14)23-19(26)13-25-11-9-16(10-12-25)24-20(27)17-3-1-2-4-18(17)22/h1-8,16H,9-13H2,(H,23,26)(H,24,27)/p+1