[2-[3-(4-nitrophenyl)propanoyl]-3,5-bis(oxidanyl)phenyl] ethanoate

Systemtic Name: [2-[3-(4-nitrophenyl)propanoyl]-3,5-bis(oxidanyl)phenyl] ethanoate Openeye Name: [3,5-dihydroxy-2-[3-(4-nitrophenyl)propanoyl]phenyl] acetate CAS Name: acetic acid [3,5-dihydroxy-2-[3-(4-nitrophenyl)-1-oxopropyl]phenyl] ester IUPAC Name: [3,5-dihydroxy-2-[3-(4-nitrophenyl)propanoyl]phenyl] acetate Traditional Name: acetic acid [3,5-dihydroxy-2-[3-(4-nitrophenyl)propanoyl]phenyl] ester Formula: C17H15NO7 MolecularWeight: 345.3035

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=CC(=C1C(=O)CCC2=CC=C(C=C2)[N+](=O)[O-])O)O

Isomeric SMILES

CC(=O)OC1=CC(=CC(=C1C(=O)CCC2=CC=C(C=C2)[N+](=O)[O-])O)O

InChI

InChI=1S/C17H15NO7/c1-10(19)25-16-9-13(20)8-15(22)17(16)14(21)7-4-11-2-5-12(6-3-11)18(23)24/h2-3,5-6,8-9,20,22H,4,7H2,1H3