[4-oxidanylidene-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 4-nitrobenzoate

Systemtic Name: [4-oxidanylidene-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 4-nitrobenzoate Openeye Name: [4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-oxo-3-[4-[oxo(propoxy)methyl]phenoxy]-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-keto-3-(4-propoxycarbonylphenoxy)chromen-7-yl] ester Formula: C26H19NO9 MolecularWeight: 489.43036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H19NO9/c1-2-13-33-25(29)16-5-9-19(10-6-16)35-23-15-34-22-14-20(11-12-21(22)24(23)28)36-26(30)17-3-7-18(8-4-17)27(31)32/h3-12,14-15H,2,13H2,1H3