1-[[4-(2,4-dimethylphenyl)-3-ethoxycarbonyl-thiophen-2-yl]iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-olate

Systemtic Name: 1-[[4-(2,4-dimethylphenyl)-3-ethoxycarbonyl-thiophen-2-yl]iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-olate Openeye Name: 1-[[4-(2,4-dimethylphenyl)-3-ethoxycarbonyl-2-thienyl]iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-olate CAS Name: 1-[[4-(2,4-dimethylphenyl)-3-ethoxycarbonyl-2-thiophenyl]iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-olate IUPAC Name: 1-[[4-(2,4-dimethylphenyl)-3-ethoxycarbonylthiophen-2-yl]iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-olate Traditional Name: 1-[[3-carbethoxy-4-(2,4-dimethylphenyl)-2-thienyl]iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-olate Formula: C28H25N2O6S- MolecularWeight: 517.5729

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=C(C=C(C=C2)C)C)N=CC3=C(C(=CC4=C3C5=C(O4)CCCC5)[N+](=O)[O-])[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=C(C=C(C=C2)C)C)N=CC3=C(C(=CC4=C3C5=C(O4)CCCC5)[N+](=O)[O-])[O-]

InChI

InChI=1S/C28H26N2O6S/c1-4-35-28(32)25-20(17-10-9-15(2)11-16(17)3)14-37-27(25)29-13-19-24-18-7-5-6-8-22(18)36-23(24)12-21(26(19)31)30(33)34/h9-14,31H,4-8H2,1-3H3/p-1