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

Systemtic Name: 9-ethyl-3-[[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]carbazole Openeye Name: 9-ethyl-3-[[4-(m-tolylmethyl)piperazine-1,4-diium-1-yl]methyl]carbazole CAS Name: 9-ethyl-3-[[4-[(3-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]carbazole IUPAC Name: 9-ethyl-3-[[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]carbazole Traditional Name: 9-ethyl-3-[[4-(3-methylbenzyl)piperazine-1,4-diium-1-yl]methyl]carbazole Formula: C27H33N3+2 MolecularWeight: 399.57102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CC[NH+](CC3)CC4=CC=CC(=C4)C)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CC[NH+](CC3)CC4=CC=CC(=C4)C)C5=CC=CC=C51

InChI

InChI=1S/C27H31N3/c1-3-30-26-10-5-4-9-24(26)25-18-23(11-12-27(25)30)20-29-15-13-28(14-16-29)19-22-8-6-7-21(2)17-22/h4-12,17-18H,3,13-16,19-20H2,1-2H3/p+2