2-[[4-(1-benzofuran-2-ylcarbonylamino)-3-methyl-phenyl]iminomethyl]-6-ethoxy-4-nitro-phenolate

Systemtic Name: 2-[[4-(1-benzofuran-2-ylcarbonylamino)-3-methyl-phenyl]iminomethyl]-6-ethoxy-4-nitro-phenolate Openeye Name: 2-[[4-(benzofuran-2-carbonylamino)-3-methyl-phenyl]iminomethyl]-6-ethoxy-4-nitro-phenolate CAS Name: 2-[[4-[[2-benzofuranyl(oxo)methyl]amino]-3-methylphenyl]iminomethyl]-6-ethoxy-4-nitrophenolate IUPAC Name: 2-[[4-(1-benzofuran-2-carbonylamino)-3-methylphenyl]iminomethyl]-6-ethoxy-4-nitrophenolate Traditional Name: 2-[[4-(benzofuran-2-carbonylamino)-3-methyl-phenyl]iminomethyl]-6-ethoxy-4-nitro-phenolate Formula: C25H20N3O6- MolecularWeight: 458.4428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)C)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)C)[O-]

InChI

InChI=1S/C25H21N3O6/c1-3-33-22-13-19(28(31)32)11-17(24(22)29)14-26-18-8-9-20(15(2)10-18)27-25(30)23-12-16-6-4-5-7-21(16)34-23/h4-14,29H,3H2,1-2H3,(H,27,30)/p-1