ethanedioic acid; 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]methyl]-2,6-dimethoxy-phenol

Systemtic Name: ethanedioic acid; 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]methyl]-2,6-dimethoxy-phenol; oxalic acid CAS Name: 4-[[4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazinyl]methyl]-2,6-dimethoxyphenol; oxalic acid IUPAC Name: 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]methyl]-2,6-dimethoxyphenol; oxalic acid Traditional Name: 4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazino]methyl]-2,6-dimethoxy-phenol; oxalic acid Formula: C30H35N3O7 MolecularWeight: 549.6148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33N3O3.C2H2O4/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;3-1(4)2(5)6/h5-10,15-17,32H,4,11-14,18-19H2,1-3H3;(H,3,4)(H,5,6)