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

Systemtic Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[5-(4-methyl-2-nitro-phenyl)furan-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[5-(4-methyl-2-nitro-phenyl)furan-2-carbonyl]amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[[5-(4-methyl-2-nitrophenyl)-2-furanyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[5-(4-methyl-2-nitrophenyl)furan-2-carbonyl]amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[[5-(4-methyl-2-nitro-phenyl)-2-furoyl]amino]benzoic acid methyl ester Formula: C26H28N4O6 MolecularWeight: 492.52372

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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=C(C=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O6/c1-4-28-11-13-29(14-12-28)21-8-6-18(26(32)35-3)16-20(21)27-25(31)24-10-9-23(36-24)19-7-5-17(2)15-22(19)30(33)34/h5-10,15-16H,4,11-14H2,1-3H3,(H,27,31)