3-(1-adamantyl)-1-phenyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-(1-adamantyl)-1-phenyl-pyrazole-4-carbaldehyde Openeye Name: 3-(1-adamantyl)-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 3-(1-adamantyl)-1-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-(1-adamantyl)-1-phenylpyrazole-4-carbaldehyde Traditional Name: 3-(1-adamantyl)-1-phenyl-pyrazole-4-carbaldehyde Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C=O)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C=O)C5=CC=CC=C5

InChI

InChI=1S/C20H22N2O/c23-13-17-12-22(18-4-2-1-3-5-18)21-19(17)20-9-14-6-15(10-20)8-16(7-14)11-20/h1-5,12-16H,6-11H2