1,3,5-tris(3,4-dimethylphenyl)pyrazole

Systemtic Name: 1,3,5-tris(3,4-dimethylphenyl)pyrazole Openeye Name: 1,3,5-tris(3,4-dimethylphenyl)pyrazole CAS Name: 1,3,5-tris(3,4-dimethylphenyl)pyrazole IUPAC Name: 1,3,5-tris(3,4-dimethylphenyl)pyrazole Traditional Name: 1,3,5-tris(3,4-dimethylphenyl)pyrazole Formula: C27H28N2 MolecularWeight: 380.52462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)C)C)C4=CC(=C(C=C4)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)C)C)C4=CC(=C(C=C4)C)C)C

InChI

InChI=1S/C27H28N2/c1-17-7-10-23(13-20(17)4)26-16-27(24-11-8-18(2)21(5)14-24)29(28-26)25-12-9-19(3)22(6)15-25/h7-16H,1-6H3