(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NOC(=C2)C3=CC=CS3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NOC(=C2)C3=CC=CS3

InChI

InChI=1S/C20H21NO6S/c1-23-16-9-13(10-17(24-2)20(16)25-3)6-7-19(22)26-12-14-11-15(27-21-14)18-5-4-8-28-18/h4-5,8-11H,6-7,12H2,1-3H3