[4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 3,5-dinitrobenzoate

Systemtic Name: [4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 3,5-dinitrobenzoate Openeye Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [4-oxo-3-(4-phenylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [4-keto-3-(4-phenylphenoxy)chromen-7-yl] ester Formula: C28H16N2O9 MolecularWeight: 524.43464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OC3=COC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OC3=COC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C28H16N2O9/c31-27-24-11-10-23(39-28(32)19-12-20(29(33)34)14-21(13-19)30(35)36)15-25(24)37-16-26(27)38-22-8-6-18(7-9-22)17-4-2-1-3-5-17/h1-16H