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

Systemtic Name: methyl 4-[2-[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[5-(3,4-dimethoxyphenyl)-3-isoxazolyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]acetyl]amino]benzoic acid 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)CC(=O)NC3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)CC(=O)NC3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C21H20N2O6/c1-26-17-9-6-14(10-19(17)27-2)18-11-16(23-29-18)12-20(24)22-15-7-4-13(5-8-15)21(25)28-3/h4-11H,12H2,1-3H3,(H,22,24)