1-[2-(9H-fluoren-9-ylamino)-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-(9H-fluoren-9-ylamino)-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[2-(9H-fluoren-9-ylamino)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(9H-fluoren-9-ylamino)-2-oxoethyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[2-(9H-fluoren-9-ylamino)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[2-(9H-fluoren-9-ylamino)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C28H30N3O2+ MolecularWeight: 440.5567

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)CC(=O)NC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)CC(=O)NC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C28H29N3O2/c32-26(30-27-24-12-6-4-10-22(24)23-11-5-7-13-25(23)27)19-31-16-14-21(15-17-31)28(33)29-18-20-8-2-1-3-9-20/h1-13,21,27H,14-19H2,(H,29,33)(H,30,32)/p+1