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

Systemtic Name: 9-ethyl-3-[[4-[(2-nitrophenyl)methyl]piperazin-4-ium-1-yl]methyl]carbazole Openeye Name: 9-ethyl-3-[[4-[(2-nitrophenyl)methyl]piperazin-4-ium-1-yl]methyl]carbazole CAS Name: 9-ethyl-3-[[4-[(2-nitrophenyl)methyl]-1-piperazin-4-iumyl]methyl]carbazole IUPAC Name: 9-ethyl-3-[[4-[(2-nitrophenyl)methyl]piperazin-4-ium-1-yl]methyl]carbazole Traditional Name: 9-ethyl-3-[[4-(2-nitrobenzyl)piperazin-4-ium-1-yl]methyl]carbazole Formula: C26H29N4O2+ MolecularWeight: 429.53406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O2/c1-2-29-25-10-6-4-8-22(25)23-17-20(11-12-26(23)29)18-27-13-15-28(16-14-27)19-21-7-3-5-9-24(21)30(31)32/h3-12,17H,2,13-16,18-19H2,1H3/p+1