4-tert-butyl-N-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzamide

Systemtic Name: 4-tert-butyl-N-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzamide Openeye Name: 4-tert-butyl-N-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzamide CAS Name: 4-tert-butyl-N-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 4-tert-butyl-N-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]methylideneamino]benzamide Traditional Name: 4-tert-butyl-N-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzamide Formula: C29H28N4O3 MolecularWeight: 480.55762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28N4O3/c1-29(2,3)23-12-9-20(10-13-23)28(34)31-30-18-22-19-33(24-7-5-4-6-8-24)32-27(22)21-11-14-25-26(17-21)36-16-15-35-25/h4-14,17-19H,15-16H2,1-3H3,(H,31,34)