3-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole

Systemtic Name: 3-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole Openeye Name: 3-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole CAS Name: 3-[[4-(2,5-dimethylphenyl)-1-piperazin-1-iumyl]methyl]-9-ethylcarbazole IUPAC Name: 3-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-9-ethylcarbazole Traditional Name: 3-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole Formula: C27H32N3+ MolecularWeight: 398.56308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3/c1-4-30-25-8-6-5-7-23(25)24-18-22(11-12-26(24)30)19-28-13-15-29(16-14-28)27-17-20(2)9-10-21(27)3/h5-12,17-18H,4,13-16,19H2,1-3H3/p+1