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

Systemtic Name: 5-[4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonylphenyl]-1,3-oxazole Openeye Name: 5-[4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonylphenyl]oxazole CAS Name: 5-[4-[[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]sulfonyl]phenyl]oxazole IUPAC Name: 5-[4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonylphenyl]-1,3-oxazole Traditional Name: 5-[4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]sulfonylphenyl]oxazole Formula: C26H24N3O3S+ MolecularWeight: 458.55206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)S(=O)(=O)C5=CC=C(C=C5)C6=CN=CO6

Isomeric SMILES

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)S(=O)(=O)C5=CC=C(C=C5)C6=CN=CO6

InChI

InChI=1S/C26H23N3O3S/c30-33(31,20-11-9-19(10-12-20)25-17-27-18-32-25)29-15-13-28(14-16-29)26-23-7-3-1-5-21(23)22-6-2-4-8-24(22)26/h1-12,17-18,26H,13-16H2/p+1