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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-tert-butyl-pyrazole-4-carbaldehyde Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-tert-butyl-pyrazole-4-carbaldehyde CAS Name: 3-(1,3-benzodioxol-5-yl)-1-tert-butyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-tert-butylpyrazole-4-carbaldehyde Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-tert-butyl-pyrazole-4-carbaldehyde Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=N1)C2=CC3=C(C=C2)OCO3)C=O

Isomeric SMILES

CC(C)(C)N1C=C(C(=N1)C2=CC3=C(C=C2)OCO3)C=O

InChI

InChI=1S/C15H16N2O3/c1-15(2,3)17-7-11(8-18)14(16-17)10-4-5-12-13(6-10)20-9-19-12/h4-8H,9H2,1-3H3