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

Systemtic Name: 3-[[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]methyl]-9-ethyl-carbazole Openeye Name: 3-[[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]methyl]-9-ethyl-carbazole CAS Name: 3-[[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]methyl]-9-ethylcarbazole IUPAC Name: 3-[[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]methyl]-9-ethylcarbazole Traditional Name: 3-[[4-(3-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(=CC=C4)Cl)C5=CC=CC=C51

Isomeric SMILES

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

InChI

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