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

Systemtic Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 2-benzamidoethanoate Openeye Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 2-benzamidoacetate CAS Name: 2-benzamidoacetic 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-benzamidoacetate Traditional Name: 2-benzamidoacetic acid [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C21H21N3O7 MolecularWeight: 427.40734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O7/c1-27-15-9-14(10-16(28-2)19(15)29-3)21-24-23-17(31-21)12-30-18(25)11-22-20(26)13-7-5-4-6-8-13/h4-10H,11-12H2,1-3H3,(H,22,26)