[3-(4-tert-butylphenoxy)-4-oxidanylidene-chromen-7-yl] 2-nitrobenzoate

Systemtic Name: [3-(4-tert-butylphenoxy)-4-oxidanylidene-chromen-7-yl] 2-nitrobenzoate Openeye Name: [3-(4-tert-butylphenoxy)-4-oxo-chromen-7-yl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [3-(4-tert-butylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-tert-butylphenoxy)-4-oxochromen-7-yl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [3-(4-tert-butylphenoxy)-4-keto-chromen-7-yl] ester Formula: C26H21NO7 MolecularWeight: 459.44744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C26H21NO7/c1-26(2,3)16-8-10-17(11-9-16)33-23-15-32-22-14-18(12-13-20(22)24(23)28)34-25(29)19-6-4-5-7-21(19)27(30)31/h4-15H,1-3H3