but-2-ynyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: but-2-ynyl 1,3-benzodioxole-5-carboxylate Openeye Name: but-2-ynyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid but-2-ynyl ester IUPAC Name: but-2-ynyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid but-2-ynyl ester Formula: C12H10O4 MolecularWeight: 218.2054

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC#CCOC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H10O4/c1-2-3-6-14-12(13)9-4-5-10-11(7-9)16-8-15-10/h4-5,7H,6,8H2,1H3