methyl 4-(4-ethylpiperazin-1-yl)-3-[[5-(3-nitrophenyl)furan-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[5-(3-nitrophenyl)furan-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[5-(3-nitrophenyl)furan-2-carbonyl]amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[[5-(3-nitrophenyl)-2-furanyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[5-(3-nitrophenyl)furan-2-carbonyl]amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[[5-(3-nitrophenyl)-2-furoyl]amino]benzoic acid methyl ester Formula: C25H26N4O6 MolecularWeight: 478.49714

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H26N4O6/c1-3-27-11-13-28(14-12-27)21-8-7-18(25(31)34-2)16-20(21)26-24(30)23-10-9-22(35-23)17-5-4-6-19(15-17)29(32)33/h4-10,15-16H,3,11-14H2,1-2H3,(H,26,30)