(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C18H14N2O6S MolecularWeight: 386.37856

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C18H14N2O6S/c21-17(23-9-12-7-15(26-20-12)16-2-1-5-27-16)8-19-18(22)11-3-4-13-14(6-11)25-10-24-13/h1-7H,8-10H2,(H,19,22)