[4-(nitrooxymethyl)phenyl]methyl 2-[4-(phenylcarbonyl)phenyl]propanoate

Systemtic Name: [4-(nitrooxymethyl)phenyl]methyl 2-[4-(phenylcarbonyl)phenyl]propanoate Openeye Name: [4-(nitrooxymethyl)phenyl]methyl 2-(4-benzoylphenyl)propanoate CAS Name: 2-(4-benzoylphenyl)propanoic acid [4-(nitrooxymethyl)phenyl]methyl ester IUPAC Name: [4-(nitrooxymethyl)phenyl]methyl 2-(4-benzoylphenyl)propanoate Traditional Name: 2-(4-benzoylphenyl)propionic acid [4-(nitrooxymethyl)benzyl] ester Formula: C24H21NO6 MolecularWeight: 419.42664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)CO[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)CO[N+](=O)[O-]

InChI

InChI=1S/C24H21NO6/c1-17(20-11-13-22(14-12-20)23(26)21-5-3-2-4-6-21)24(27)30-15-18-7-9-19(10-8-18)16-31-25(28)29/h2-14,17H,15-16H2,1H3