3-[[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-9-ethyl-carbazole; ethanedioic acid

Systemtic Name: 3-[[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-9-ethyl-carbazole; ethanedioic acid Openeye Name: 3-[[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-9-ethyl-carbazole; oxalic acid CAS Name: 3-[[4-[(3,5-dimethoxyphenyl)methyl]-1-piperazinyl]methyl]-9-ethylcarbazole; oxalic acid IUPAC Name: 3-[[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-9-ethylcarbazole; oxalic acid Traditional Name: 3-[[4-(3,5-dimethoxybenzyl)piperazino]methyl]-9-ethyl-carbazole; oxalic acid Formula: C30H35N3O6 MolecularWeight: 533.6154

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)CC4=CC(=CC(=C4)OC)OC)C5=CC=CC=C51.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)CC4=CC(=CC(=C4)OC)OC)C5=CC=CC=C51.C(=O)(C(=O)O)O

InChI

InChI=1S/C28H33N3O2.C2H2O4/c1-4-31-27-8-6-5-7-25(27)26-17-21(9-10-28(26)31)19-29-11-13-30(14-12-29)20-22-15-23(32-2)18-24(16-22)33-3;3-1(4)2(5)6/h5-10,15-18H,4,11-14,19-20H2,1-3H3;(H,3,4)(H,5,6)