N-[1-[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[1-[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-3-fluoranyl-benzamide Openeye Name: N-[1-[2-(2,6-diethylanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-3-fluoro-benzamide CAS Name: N-[1-[2-(2,6-diethylanilino)-2-oxoethyl]-4-piperidin-1-iumyl]-3-fluorobenzamide IUPAC Name: N-[1-[2-(2,6-diethylanilino)-2-oxoethyl]piperidin-1-ium-4-yl]-3-fluorobenzamide Traditional Name: N-[1-[2-(2,6-diethylanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]-3-fluoro-benzamide Formula: C24H31FN3O2+ MolecularWeight: 412.520243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C24H30FN3O2/c1-3-17-7-5-8-18(4-2)23(17)27-22(29)16-28-13-11-21(12-14-28)26-24(30)19-9-6-10-20(25)15-19/h5-10,15,21H,3-4,11-14,16H2,1-2H3,(H,26,30)(H,27,29)/p+1