ethyl 4-(4-ethylpiperazin-1-yl)-3-[(5-nitrofuran-2-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[(5-nitrofuran-2-yl)carbonylamino]benzoate Openeye Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[(5-nitrofuran-2-carbonyl)amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[(5-nitro-2-furanyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[(5-nitrofuran-2-carbonyl)amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[(5-nitro-2-furoyl)amino]benzoic acid ethyl ester Formula: C20H24N4O6 MolecularWeight: 416.42776

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6/c1-3-22-9-11-23(12-10-22)16-6-5-14(20(26)29-4-2)13-15(16)21-19(25)17-7-8-18(30-17)24(27)28/h5-8,13H,3-4,9-12H2,1-2H3,(H,21,25)