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

Systemtic Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)but-2-enamide Openeye Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)but-2-enamide CAS Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-butenamide IUPAC Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)but-2-enamide Traditional Name: (E)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)but-2-enamide Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC2=C(C=C1)OCCO2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

C/C(=C\C(=O)NC1=CC2=C(C=C1)OCCO2)/C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H25NO3/c1-15(16-5-7-17(8-6-16)22(2,3)4)13-21(24)23-18-9-10-19-20(14-18)26-12-11-25-19/h5-10,13-14H,11-12H2,1-4H3,(H,23,24)/b15-13+