[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoate

Systemtic Name: [2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoate Openeye Name: [2-(4-methyl-3-nitro-phenyl)-2-oxo-ethyl] 2-(4-methyl-2-oxo-chromen-7-yl)oxyacetate CAS Name: 2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]acetic acid [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 2-(4-methyl-2-oxochromen-7-yl)oxyacetate Traditional Name: 2-(2-keto-4-methyl-chromen-7-yl)oxyacetic acid [2-keto-2-(4-methyl-3-nitro-phenyl)ethyl] ester Formula: C21H17NO8 MolecularWeight: 411.36158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H17NO8/c1-12-3-4-14(8-17(12)22(26)27)18(23)10-29-21(25)11-28-15-5-6-16-13(2)7-20(24)30-19(16)9-15/h3-9H,10-11H2,1-2H3