3-(1-benzofuran-2-yl)-1-(2-methylpropyl)pyrazole-4-carbaldehyde

Systemtic Name: 3-(1-benzofuran-2-yl)-1-(2-methylpropyl)pyrazole-4-carbaldehyde Openeye Name: 3-(benzofuran-2-yl)-1-isobutyl-pyrazole-4-carbaldehyde CAS Name: 3-(2-benzofuranyl)-1-(2-methylpropyl)-4-pyrazolecarboxaldehyde IUPAC Name: 3-(1-benzofuran-2-yl)-1-(2-methylpropyl)pyrazole-4-carbaldehyde Traditional Name: 3-(benzofuran-2-yl)-1-isobutyl-pyrazole-4-carbaldehyde Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=N1)C2=CC3=CC=CC=C3O2)C=O

Isomeric SMILES

CC(C)CN1C=C(C(=N1)C2=CC3=CC=CC=C3O2)C=O

InChI

InChI=1S/C16H16N2O2/c1-11(2)8-18-9-13(10-19)16(17-18)15-7-12-5-3-4-6-14(12)20-15/h3-7,9-11H,8H2,1-2H3