4-bromanyl-2-[(E)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]iminomethyl]phenolate

Systemtic Name: 4-bromanyl-2-[(E)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]iminomethyl]phenolate Openeye Name: 4-bromo-2-[(E)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]iminomethyl]phenolate CAS Name: 4-bromo-2-[(E)-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]iminomethyl]phenolate IUPAC Name: 4-bromo-2-[(E)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]iminomethyl]phenolate Traditional Name: 4-bromo-2-[(E)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]iminomethyl]phenolate Formula: C24H22BrN3O MolecularWeight: 448.35498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)N=CC5=C(C=CC(=C5)Br)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)/N=C/C5=C(C=CC(=C5)Br)[O-]

InChI

InChI=1S/C24H22BrN3O/c25-18-9-10-23(29)17(15-18)16-26-28-13-11-27(12-14-28)24-21-7-3-1-5-19(21)20-6-2-4-8-22(20)24/h1-10,15-16,24,29H,11-14H2/b26-16+