[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 2-phenethylbenzoate

Systemtic Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 2-phenethylbenzoate Openeye Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)COC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)COC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

InChI

InChI=1S/C27H26N2O6/c1-31-22-15-20(16-23(32-2)25(22)33-3)26-29-28-24(35-26)17-34-27(30)21-12-8-7-11-19(21)14-13-18-9-5-4-6-10-18/h4-12,15-16H,13-14,17H2,1-3H3