N-[1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-4-fluoranyl-benzamide Openeye Name: 4-fluoro-N-[1-[2-(indan-5-ylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]benzamide CAS Name: N-[1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-4-piperidin-1-iumyl]-4-fluorobenzamide IUPAC Name: N-[1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-[1-[2-(indan-5-ylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]benzamide Formula: C23H27FN3O2+ MolecularWeight: 396.477783

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)C[NH+]3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)C[NH+]3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN3O2/c24-19-7-4-17(5-8-19)23(29)26-20-10-12-27(13-11-20)15-22(28)25-21-9-6-16-2-1-3-18(16)14-21/h4-9,14,20H,1-3,10-13,15H2,(H,25,28)(H,26,29)/p+1