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

Systemtic Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole Openeye Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole CAS Name: 3-[[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]methyl]-9-ethylcarbazole IUPAC Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-9-ethylcarbazole Traditional Name: 9-ethyl-3-[(4-o-phenetylpiperazin-1-ium-1-yl)methyl]carbazole Formula: C27H32N3O+ MolecularWeight: 414.56248

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4OCC)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4OCC)C5=CC=CC=C51

InChI

InChI=1S/C27H31N3O/c1-3-30-24-10-6-5-9-22(24)23-19-21(13-14-25(23)30)20-28-15-17-29(18-16-28)26-11-7-8-12-27(26)31-4-2/h5-14,19H,3-4,15-18,20H2,1-2H3/p+1