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

Systemtic Name: 2-[[4-(1-benzofuran-2-ylcarbonylamino)-3-methyl-phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[4-(benzofuran-2-carbonylamino)-3-methyl-phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[4-[[2-benzofuranyl(oxo)methyl]amino]-3-methylphenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[4-(1-benzofuran-2-carbonylamino)-3-methylphenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[4-(benzofuran-2-carbonylamino)-3-methyl-phenyl]iminomethyl]-4-nitro-phenolate Formula: C23H16N3O5- MolecularWeight: 414.39024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC(=C1)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H17N3O5/c1-14-10-17(24-13-16-11-18(26(29)30)7-9-20(16)27)6-8-19(14)25-23(28)22-12-15-4-2-3-5-21(15)31-22/h2-13,27H,1H3,(H,25,28)/p-1