1-(3-bromanyl-4-methoxy-phenyl)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]methanimine

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]methanimine Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]methanimine CAS Name: 1-(3-bromo-4-methoxyphenyl)-N-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]methanimine IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]methanimine Traditional Name: (E)-(3-bromo-4-methoxy-benzylidene)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]amine Formula: C25H25BrN3O+ MolecularWeight: 463.3895

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NN2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/N2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35)Br

InChI

InChI=1S/C25H24BrN3O/c1-30-24-11-10-18(16-23(24)26)17-27-29-14-12-28(13-15-29)25-21-8-4-2-6-19(21)20-7-3-5-9-22(20)25/h2-11,16-17,25H,12-15H2,1H3/p+1/b27-17+