1-tert-butyl-3-(4-propoxyphenyl)pyrazole-4-carbaldehyde

Systemtic Name: 1-tert-butyl-3-(4-propoxyphenyl)pyrazole-4-carbaldehyde Openeye Name: 1-tert-butyl-3-(4-propoxyphenyl)pyrazole-4-carbaldehyde CAS Name: 1-tert-butyl-3-(4-propoxyphenyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-tert-butyl-3-(4-propoxyphenyl)pyrazole-4-carbaldehyde Traditional Name: 1-tert-butyl-3-(4-propoxyphenyl)pyrazole-4-carbaldehyde Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(C=C2C=O)C(C)(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(C=C2C=O)C(C)(C)C

InChI

InChI=1S/C17H22N2O2/c1-5-10-21-15-8-6-13(7-9-15)16-14(12-20)11-19(18-16)17(2,3)4/h6-9,11-12H,5,10H2,1-4H3