(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,4,5-trimethoxyphenyl)-2-propenoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-asarylacrylic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C20H19NO6S MolecularWeight: 401.43296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)OCC2=NOC(=C2)C3=CC=CS3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)OCC2=NOC(=C2)C3=CC=CS3)OC)OC

InChI

InChI=1S/C20H19NO6S/c1-23-15-11-17(25-3)16(24-2)9-13(15)6-7-20(22)26-12-14-10-18(27-21-14)19-5-4-8-28-19/h4-11H,12H2,1-3H3/b7-6+