2-(4-bromanyl-2-methanoyl-phenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-(4-bromanyl-2-methanoyl-phenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(4-bromo-2-formyl-phenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-thienylmethyl)acetamide CAS Name: 2-(4-bromo-2-formylphenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(4-bromo-2-formylphenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-(4-bromo-2-formyl-phenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-thenyl)acetamide Formula: C22H18BrNO5S MolecularWeight: 488.35102

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N(CC3=CC=CS3)C(=O)COC4=C(C=C(C=C4)Br)C=O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N(CC3=CC=CS3)C(=O)COC4=C(C=C(C=C4)Br)C=O

InChI

InChI=1S/C22H18BrNO5S/c23-16-3-5-19(15(10-16)13-25)29-14-22(26)24(12-18-2-1-9-30-18)17-4-6-20-21(11-17)28-8-7-27-20/h1-6,9-11,13H,7-8,12,14H2