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

Systemtic Name: 3-[[4-[(4-ethoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole Openeye Name: 3-[[4-[(4-ethoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole CAS Name: 3-[[4-[(4-ethoxyphenyl)methyl]-1-piperazin-1-iumyl]methyl]-9-ethylcarbazole IUPAC Name: 3-[[4-[(4-ethoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-9-ethylcarbazole Traditional Name: 3-[[4-(4-ethoxybenzyl)piperazin-1-ium-1-yl]methyl]-9-ethyl-carbazole Formula: C28H34N3O+ MolecularWeight: 428.58906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33N3O/c1-3-31-27-8-6-5-7-25(27)26-19-23(11-14-28(26)31)21-30-17-15-29(16-18-30)20-22-9-12-24(13-10-22)32-4-2/h5-14,19H,3-4,15-18,20-21H2,1-2H3/p+1