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

Systemtic Name: 9-ethyl-3-[[4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]carbazole Openeye Name: 9-ethyl-3-[[4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]carbazole CAS Name: 9-ethyl-3-[[4-[(3-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]carbazole IUPAC Name: 9-ethyl-3-[[4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]carbazole Traditional Name: 9-ethyl-3-[(4-m-anisylpiperazine-1,4-diium-1-yl)methyl]carbazole Formula: C27H33N3O+2 MolecularWeight: 415.57042

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)OC)C5=CC=CC=C51

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O/c1-3-30-26-10-5-4-9-24(26)25-18-22(11-12-27(25)30)20-29-15-13-28(14-16-29)19-21-7-6-8-23(17-21)31-2/h4-12,17-18H,3,13-16,19-20H2,1-2H3/p+2