N-(4-tert-butylphenyl)-1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methanimine

Systemtic Name: N-(4-tert-butylphenyl)-1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methanimine Openeye Name: N-(4-tert-butylphenyl)-1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methanimine CAS Name: N-(4-tert-butylphenyl)-1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]methanimine IUPAC Name: N-(4-tert-butylphenyl)-1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]methanimine Traditional Name: (4-tert-butylphenyl)-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylene]amine Formula: C28H27N3O2 MolecularWeight: 437.53288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O2/c1-28(2,3)22-10-12-23(13-11-22)29-18-21-19-31(24-7-5-4-6-8-24)30-27(21)20-9-14-25-26(17-20)33-16-15-32-25/h4-14,17-19H,15-16H2,1-3H3