[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 2-benzamidoethanoate

Systemtic Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 2-benzamidoethanoate Openeye Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl 2-benzamidoacetate CAS Name: 2-benzamidoacetic acid [5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 2-benzamidoacetate Traditional Name: 2-benzamidoacetic acid [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)CNC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)CNC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H20N2O6/c1-26-17-9-8-15(10-19(17)27-2)18-11-16(23-29-18)13-28-20(24)12-22-21(25)14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3,(H,22,25)