tert-butyl 4-[[(2E)-2-hydroxyiminoethanoyl]oxymethyl]-2,2-dimethyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: tert-butyl 4-[[(2E)-2-hydroxyiminoethanoyl]oxymethyl]-2,2-dimethyl-1,3-benzodioxole-5-carboxylate Openeye Name: tert-butyl 4-[[(2E)-2-hydroxyiminoacetyl]oxymethyl]-2,2-dimethyl-1,3-benzodioxole-5-carboxylate CAS Name: 4-[[(2E)-2-hydroxyimino-1-oxoethoxy]methyl]-2,2-dimethyl-1,3-benzodioxole-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(2E)-2-hydroxyiminoacetyl]oxymethyl]-2,2-dimethyl-1,3-benzodioxole-5-carboxylate Traditional Name: 4-[[(2E)-2-hydroximinoacetyl]oxymethyl]-2,2-dimethyl-piperonylic acid tert-butyl ester Formula: C17H21NO7 MolecularWeight: 351.35114

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(O1)C(=C(C=C2)C(=O)OC(C)(C)C)COC(=O)C=NO)C

Isomeric SMILES

CC1(OC2=C(O1)C(=C(C=C2)C(=O)OC(C)(C)C)COC(=O)/C=N/O)C

InChI

InChI=1S/C17H21NO7/c1-16(2,3)25-15(20)10-6-7-12-14(24-17(4,5)23-12)11(10)9-22-13(19)8-18-21/h6-8,21H,9H2,1-5H3/b18-8+