ethyl 4-(4-ethylpiperazin-1-yl)-3-[2-(2-nitrophenoxy)ethanoylamino]benzoate

Systemtic Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[2-(2-nitrophenoxy)ethanoylamino]benzoate Openeye Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(2-nitrophenoxy)acetyl]amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(2-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[[2-(2-nitrophenoxy)acetyl]amino]benzoic acid ethyl ester Formula: C23H28N4O6 MolecularWeight: 456.49162

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O6/c1-3-25-11-13-26(14-12-25)19-10-9-17(23(29)32-4-2)15-18(19)24-22(28)16-33-21-8-6-5-7-20(21)27(30)31/h5-10,15H,3-4,11-14,16H2,1-2H3,(H,24,28)