3-phenylpropyl 3-[2-(4-nitrophenoxy)propanoyloxy]benzoate

Systemtic Name: 3-phenylpropyl 3-[2-(4-nitrophenoxy)propanoyloxy]benzoate Openeye Name: 3-phenylpropyl 3-[2-(4-nitrophenoxy)propanoyloxy]benzoate CAS Name: 3-[2-(4-nitrophenoxy)-1-oxopropoxy]benzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-[2-(4-nitrophenoxy)propanoyloxy]benzoate Traditional Name: 3-[2-(4-nitrophenoxy)propanoyloxy]benzoic acid 3-phenylpropyl ester Formula: C25H23NO7 MolecularWeight: 449.45262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=CC(=C1)C(=O)OCCCC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC1=CC=CC(=C1)C(=O)OCCCC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H23NO7/c1-18(32-22-14-12-21(13-15-22)26(29)30)24(27)33-23-11-5-10-20(17-23)25(28)31-16-6-9-19-7-3-2-4-8-19/h2-5,7-8,10-15,17-18H,6,9,16H2,1H3