(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 7-chloranyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 7-chloranyl-1,3-benzodioxole-5-carboxylate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 7-chloro-1,3-benzodioxole-5-carboxylate CAS Name: 7-chloro-1,3-benzodioxole-5-carboxylic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 7-chloro-1,3-benzodioxole-5-carboxylate Traditional Name: 7-chloro-piperonylic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C17H11ClN2O5 MolecularWeight: 358.73264

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C(=O)OCC3=NN=C(O3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)C(=O)OCC3=NN=C(O3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C17H11ClN2O5/c18-12-6-11(7-13-15(12)24-9-23-13)17(21)22-8-14-19-20-16(25-14)10-4-2-1-3-5-10/h1-7H,8-9H2