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

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

Click to see the large picture

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