(4,5-dimethoxy-2-nitro-phenyl)methyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1-carboxylate

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1-carboxylate Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)methyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazinecarboxylic acid (4,5-dimethoxy-2-nitrophenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(9-ethylcarbazol-3-yl)methyl]piperazine-1-carboxylic acid (4,5-dimethoxy-2-nitro-benzyl) ester Formula: C29H32N4O6 MolecularWeight: 532.58758

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)C(=O)OCC4=CC(=C(C=C4[N+](=O)[O-])OC)OC)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)C(=O)OCC4=CC(=C(C=C4[N+](=O)[O-])OC)OC)C5=CC=CC=C51

InChI

InChI=1S/C29H32N4O6/c1-4-32-24-8-6-5-7-22(24)23-15-20(9-10-25(23)32)18-30-11-13-31(14-12-30)29(34)39-19-21-16-27(37-2)28(38-3)17-26(21)33(35)36/h5-10,15-17H,4,11-14,18-19H2,1-3H3