9-ethyl-3-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]carbazole

Systemtic Name: 9-ethyl-3-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]carbazole Openeye Name: 3-[(4-cinnamylpiperazine-1,4-diium-1-yl)methyl]-9-ethyl-carbazole CAS Name: 9-ethyl-3-[[4-(3-phenylprop-2-enyl)-1-piperazine-1,4-diiumyl]methyl]carbazole IUPAC Name: 9-ethyl-3-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]carbazole Traditional Name: 3-[(4-cinnamylpiperazine-1,4-diium-1-yl)methyl]-9-ethyl-carbazole Formula: C28H33N3+2 MolecularWeight: 411.58172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CC[NH+](CC3)CC=CC4=CC=CC=C4)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CC[NH+](CC3)CC=CC4=CC=CC=C4)C5=CC=CC=C51

InChI

InChI=1S/C28H31N3/c1-2-31-27-13-7-6-12-25(27)26-21-24(14-15-28(26)31)22-30-19-17-29(18-20-30)16-8-11-23-9-4-3-5-10-23/h3-15,21H,2,16-20,22H2,1H3/p+2