1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazine-1,4-diium-1-yl]propan-2-ol; ethanedioate

Systemtic Name: 1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazine-1,4-diium-1-yl]propan-2-ol; ethanedioate Openeye Name: 1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazine-1,4-diium-1-yl]propan-2-ol; oxalate CAS Name: 1-(9-carbazolyl)-3-[4-[2-(4-methylphenoxy)ethyl]-1-piperazine-1,4-diiumyl]-2-propanol; oxalate IUPAC Name: 1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazine-1,4-diium-1-yl]propan-2-ol; oxalate Traditional Name: 1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazine-1,4-diium-1-yl]propan-2-ol; oxalate Formula: C30H35N3O6 MolecularWeight: 533.6154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)CC(CN3C4=CC=CC=C4C5=CC=CC=C53)O.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)CC(CN3C4=CC=CC=C4C5=CC=CC=C53)O.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C28H33N3O2.C2H2O4/c1-22-10-12-24(13-11-22)33-19-18-29-14-16-30(17-15-29)20-23(32)21-31-27-8-4-2-6-25(27)26-7-3-5-9-28(26)31;3-1(4)2(5)6/h2-13,23,32H,14-21H2,1H3;(H,3,4)(H,5,6)