[4-oxidanylidene-3-(2-propan-2-ylphenoxy)chromen-7-yl] 4-nitrobenzoate

Systemtic Name: [4-oxidanylidene-3-(2-propan-2-ylphenoxy)chromen-7-yl] 4-nitrobenzoate Openeye Name: [3-(2-isopropylphenoxy)-4-oxo-chromen-7-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-oxo-3-(2-propan-2-ylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(2-propan-2-ylphenoxy)chromen-7-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-(2-isopropylphenoxy)-4-keto-chromen-7-yl] ester Formula: C25H19NO7 MolecularWeight: 445.42086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H19NO7/c1-15(2)19-5-3-4-6-21(19)33-23-14-31-22-13-18(11-12-20(22)24(23)27)32-25(28)16-7-9-17(10-8-16)26(29)30/h3-15H,1-2H3