5-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-5-keto-3,3-dimethyl-valerate Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)N1CC[NH+](CC1)C2C3=CC=CC=C3C4=CC=CC=C24)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC(=O)N1CC[NH+](CC1)C2C3=CC=CC=C3C4=CC=CC=C24)CC(=O)[O-]

InChI

InChI=1S/C24H28N2O3/c1-24(2,16-22(28)29)15-21(27)25-11-13-26(14-12-25)23-19-9-5-3-7-17(19)18-8-4-6-10-20(18)23/h3-10,23H,11-16H2,1-2H3,(H,28,29)