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

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

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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(=CC=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(=CC=C4)[N+](=O)[O-]

InChI

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