3-(4-methyl-3-nitro-phenyl)-1-(2-methylpropyl)pyrazole-4-carbaldehyde

Systemtic Name: 3-(4-methyl-3-nitro-phenyl)-1-(2-methylpropyl)pyrazole-4-carbaldehyde Openeye Name: 1-isobutyl-3-(4-methyl-3-nitro-phenyl)pyrazole-4-carbaldehyde CAS Name: 3-(4-methyl-3-nitrophenyl)-1-(2-methylpropyl)-4-pyrazolecarboxaldehyde IUPAC Name: 3-(4-methyl-3-nitrophenyl)-1-(2-methylpropyl)pyrazole-4-carbaldehyde Traditional Name: 1-isobutyl-3-(4-methyl-3-nitro-phenyl)pyrazole-4-carbaldehyde Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C=O)CC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C=O)CC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O3/c1-10(2)7-17-8-13(9-19)15(16-17)12-5-4-11(3)14(6-12)18(20)21/h4-6,8-10H,7H2,1-3H3