[3-[3-(4-cyanophenyl)propanoyloxymethyl]phenyl]methyl 3-(4-cyanophenyl)propanoate

Systemtic Name: [3-[3-(4-cyanophenyl)propanoyloxymethyl]phenyl]methyl 3-(4-cyanophenyl)propanoate Openeye Name: [3-[3-(4-cyanophenyl)propanoyloxymethyl]phenyl]methyl 3-(4-cyanophenyl)propanoate CAS Name: 3-(4-cyanophenyl)propanoic acid [3-[[3-(4-cyanophenyl)-1-oxopropoxy]methyl]phenyl]methyl ester IUPAC Name: [3-[3-(4-cyanophenyl)propanoyloxymethyl]phenyl]methyl 3-(4-cyanophenyl)propanoate Traditional Name: 3-(4-cyanophenyl)propionic acid [3-[3-(4-cyanophenyl)propanoyloxymethyl]benzyl] ester Formula: C28H24N2O4 MolecularWeight: 452.50116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC(=O)CCC2=CC=C(C=C2)C#N)COC(=O)CCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)COC(=O)CCC2=CC=C(C=C2)C#N)COC(=O)CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C28H24N2O4/c29-17-23-8-4-21(5-9-23)12-14-27(31)33-19-25-2-1-3-26(16-25)20-34-28(32)15-13-22-6-10-24(18-30)11-7-22/h1-11,16H,12-15,19-20H2