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

Systemtic Name: 3-[[4-[(2-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-9-ethyl-carbazole Openeye Name: 3-[[4-[(2-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-9-ethyl-carbazole CAS Name: 3-[[4-[(2-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]-9-ethylcarbazole IUPAC Name: 3-[[4-[(2-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-9-ethylcarbazole Traditional Name: 3-[[4-(2-chlorobenzyl)piperazine-1,4-diium-1-yl]methyl]-9-ethyl-carbazole Formula: C26H30ClN3+2 MolecularWeight: 419.9895

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4Cl)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4Cl)C5=CC=CC=C51

InChI

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