[1-(phenyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl] 4-nitrobenzoate

Systemtic Name: [1-(phenyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl] 4-nitrobenzoate Openeye Name: [1-(phenyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [1-(phenyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl] ester IUPAC Name: [1-(phenyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [1-(phenyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl] ester Formula: C26H20N2O5 MolecularWeight: 440.4474

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(O2)C=CC(=C3C=NC4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C3=C(O2)C=CC(=C3C=NC4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H20N2O5/c29-26(17-10-12-19(13-11-17)28(30)31)33-23-14-15-24-25(20-8-4-5-9-22(20)32-24)21(23)16-27-18-6-2-1-3-7-18/h1-3,6-7,10-16H,4-5,8-9H2