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

Systemtic Name: N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-(4-propoxyphenyl)methanimine Openeye Name: N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-(4-propoxyphenyl)methanimine CAS Name: N-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]-1-(4-propoxyphenyl)methanimine IUPAC Name: N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-(4-propoxyphenyl)methanimine Traditional Name: (E)-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-(4-propoxybenzylidene)amine Formula: C27H30N3O+ MolecularWeight: 412.5466

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=NN2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=N/N2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C27H29N3O/c1-2-19-31-22-13-11-21(12-14-22)20-28-30-17-15-29(16-18-30)27-25-9-5-3-7-23(25)24-8-4-6-10-26(24)27/h3-14,20,27H,2,15-19H2,1H3/p+1/b28-20+