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

Systemtic Name: 3-[[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methyl]-9-ethyl-carbazole Openeye Name: 3-[[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methyl]-9-ethyl-carbazole CAS Name: 3-[[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]methyl]-9-ethylcarbazole IUPAC Name: 3-[[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methyl]-9-ethylcarbazole Traditional Name: 3-[[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]methyl]-9-ethyl-carbazole Formula: C26H29ClN3+ MolecularWeight: 418.98156

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CC[NH+](CC3)CC4=CC=C(C=C4)Cl)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CC[NH+](CC3)CC4=CC=C(C=C4)Cl)C5=CC=CC=C51

InChI

InChI=1S/C26H28ClN3/c1-2-30-25-6-4-3-5-23(25)24-17-21(9-12-26(24)30)19-29-15-13-28(14-16-29)18-20-7-10-22(27)11-8-20/h3-12,17H,2,13-16,18-19H2,1H3/p+1