3-(1,3-benzodioxol-5-yl)-1-methyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-methyl-pyrazole-4-carbaldehyde Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-methyl-pyrazole-4-carbaldehyde CAS Name: 3-(1,3-benzodioxol-5-yl)-1-methyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-methylpyrazole-4-carbaldehyde Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-methyl-pyrazole-4-carbaldehyde Formula: C12H10N2O3 MolecularWeight: 230.2194

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCO3)C=O

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCO3)C=O

InChI

InChI=1S/C12H10N2O3/c1-14-5-9(6-15)12(13-14)8-2-3-10-11(4-8)17-7-16-10/h2-6H,7H2,1H3