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1,3-benzodioxole-5-carbaldehyde; butan-1-olate

1,3-benzodioxole-5-carbaldehyde; butan-1-olate

Systemtic Name:1,3-benzodioxole-5-carbaldehyde; butan-1-olate
Openeye Name:1,3-benzodioxole-5-carbaldehyde; butan-1-olate
CAS Name:1,3-benzodioxole-5-carboxaldehyde; 1-butanolate
IUPAC Name:1,3-benzodioxole-5-carbaldehyde; butan-1-olate
Traditional Name:butan-1-olate; piperonal
Formula: C12H15O4-
MolecularWeight: 223.2451
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[O-].C1OC2=C(O1)C=C(C=C2)C=O


Isomeric SMILES

CCCC[O-].C1OC2=C(O1)C=C(C=C2)C=O


InChI

InChI=1S/C8H6O3.C4H9O/c9-4-6-1-2-7-8(3-6)11-5-10-7;1-2-3-4-5/h1-4H,5H2;2-4H2,1H3/q;-1


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