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

Systemtic Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[2-(4-nitrophenyl)ethanoylamino]benzoate Openeye Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(4-nitrophenyl)acetyl]amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[2-(4-nitrophenyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(4-nitrophenyl)acetyl]amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[[2-(4-nitrophenyl)acetyl]amino]benzoic acid ethyl ester Formula: C23H28N4O5 MolecularWeight: 440.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O5/c1-3-25-11-13-26(14-12-25)21-10-7-18(23(29)32-4-2)16-20(21)24-22(28)15-17-5-8-19(9-6-17)27(30)31/h5-10,16H,3-4,11-15H2,1-2H3,(H,24,28)