N-[4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]phenyl]ethanamide

Systemtic Name: N-[4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]phenyl]acetamide CAS Name: N-[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]phenyl]acetamide IUPAC Name: N-[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]phenyl]acetamide Formula: C17H16BrNO3S MolecularWeight: 394.28284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C17H16BrNO3S/c1-11(20)19-13-2-4-14(5-3-13)23-10-12-8-16-17(9-15(12)18)22-7-6-21-16/h2-5,8-9H,6-7,10H2,1H3,(H,19,20)