4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxy-phenol

Systemtic Name: 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxy-phenol CAS Name: 4-[[4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazine-1,4-diiumyl]methyl]-2,6-dimethoxyphenol IUPAC Name: 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxyphenol Traditional Name: 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxy-phenol Formula: C28H35N3O3+2 MolecularWeight: 461.5958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33N3O3/c1-4-31-24-8-6-5-7-22(24)23-15-20(9-10-25(23)31)18-29-11-13-30(14-12-29)19-21-16-26(33-2)28(32)27(17-21)34-3/h5-10,15-17,32H,4,11-14,18-19H2,1-3H3/p+2