4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonyl-3,5-dimethyl-isoxazole CAS Name: 4-[[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]sulfonyl]-3,5-dimethylisoxazole IUPAC Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonyl-3,5-dimethyl-isoxazole Formula: C22H24N3O3S+ MolecularWeight: 410.50926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C22H23N3O3S/c1-15-22(16(2)28-23-15)29(26,27)25-13-11-24(12-14-25)21-19-9-5-3-7-17(19)18-8-4-6-10-20(18)21/h3-10,21H,11-14H2,1-2H3/p+1