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

Systemtic Name: 3-tert-butyl-1-(4-nitrophenyl)pyrazole-4-carbaldehyde Openeye Name: 3-tert-butyl-1-(4-nitrophenyl)pyrazole-4-carbaldehyde CAS Name: 3-tert-butyl-1-(4-nitrophenyl)-4-pyrazolecarboxaldehyde IUPAC Name: 3-tert-butyl-1-(4-nitrophenyl)pyrazole-4-carbaldehyde Traditional Name: 3-tert-butyl-1-(4-nitrophenyl)pyrazole-4-carbaldehyde Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1C=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NN(C=C1C=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O3/c1-14(2,3)13-10(9-18)8-16(15-13)11-4-6-12(7-5-11)17(19)20/h4-9H,1-3H3