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

Systemtic Name: N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-(3-phenoxyphenyl)methanimine Openeye Name: N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-(3-phenoxyphenyl)methanimine CAS Name: N-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]-1-(3-phenoxyphenyl)methanimine IUPAC Name: N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-(3-phenoxyphenyl)methanimine Traditional Name: (E)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-(3-phenoxybenzylidene)amine Formula: C30H28N3O+ MolecularWeight: 446.56282

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)N=CC5=CC(=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)/N=C/C5=CC(=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C30H27N3O/c1-2-10-24(11-3-1)34-25-12-8-9-23(21-25)22-31-33-19-17-32(18-20-33)30-28-15-6-4-13-26(28)27-14-5-7-16-29(27)30/h1-16,21-22,30H,17-20H2/p+1/b31-22+