(E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyridin-3-yl-but-2-enamide

Systemtic Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyridin-3-yl-but-2-enamide Openeye Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-pyridyl)but-2-enamide CAS Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-pyridinyl)-2-butenamide IUPAC Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyridin-3-ylbut-2-enamide Traditional Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-pyridyl)but-2-enamide Formula: C27H28N2O3 MolecularWeight: 428.52282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=CC(=O)NC2=CC3=C(C=C2)OCCO3)CC4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C(=C/C(=O)NC2=CC3=C(C=C2)OCCO3)/CC4=CN=CC=C4

InChI

InChI=1S/C27H28N2O3/c1-27(2,3)22-8-6-20(7-9-22)21(15-19-5-4-12-28-18-19)16-26(30)29-23-10-11-24-25(17-23)32-14-13-31-24/h4-12,16-18H,13-15H2,1-3H3,(H,29,30)/b21-16+