3-[[4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]piperazin-1-yl]methyl]-9-ethyl-carbazole; ethanedioic acid

Systemtic Name: 3-[[4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]piperazin-1-yl]methyl]-9-ethyl-carbazole; ethanedioic acid Openeye Name: 3-[[4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]piperazin-1-yl]methyl]-9-ethyl-carbazole; oxalic acid CAS Name: 3-[[4-[(4,5-dimethoxy-2-nitrophenyl)methyl]-1-piperazinyl]methyl]-9-ethylcarbazole; oxalic acid IUPAC Name: 3-[[4-[(4,5-dimethoxy-2-nitrophenyl)methyl]piperazin-1-yl]methyl]-9-ethylcarbazole; oxalic acid Traditional Name: 3-[[4-(4,5-dimethoxy-2-nitro-benzyl)piperazino]methyl]-9-ethyl-carbazole; oxalic acid Formula: C30H34N4O8 MolecularWeight: 578.61296

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)CC4=CC(=C(C=C4[N+](=O)[O-])OC)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[N+](=O)[O-])OC)OC)C5=CC=CC=C51.C(=O)(C(=O)O)O

InChI

InChI=1S/C28H32N4O4.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)19-21-16-27(35-2)28(36-3)17-26(21)32(33)34;3-1(4)2(5)6/h5-10,15-17H,4,11-14,18-19H2,1-3H3;(H,3,4)(H,5,6)