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

Systemtic Name: (Z)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidin-1-yl-but-2-enamide Openeye Name: (Z)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidin-1-yl-but-2-enamide CAS Name: (Z)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(1-pyrrolidinyl)-2-butenamide IUPAC Name: (Z)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidin-1-ylbut-2-enamide Traditional Name: (Z)-3-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidino-but-2-enamide Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=CC(=O)NC2=CC3=C(C=C2)OCCO3)CN4CCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C(=C/C(=O)NC2=CC3=C(C=C2)OCCO3)/CN4CCCC4

InChI

InChI=1S/C26H32N2O3/c1-26(2,3)21-8-6-19(7-9-21)20(18-28-12-4-5-13-28)16-25(29)27-22-10-11-23-24(17-22)31-15-14-30-23/h6-11,16-17H,4-5,12-15,18H2,1-3H3,(H,27,29)/b20-16+