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

Systemtic Name: 2-bromanyl-N-[7-(4-methylphenyl)carbonyl-2,3-dihydro-1,4-benzodioxin-6-yl]ethanamide Openeye Name: 2-bromo-N-[7-(4-methylbenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]acetamide CAS Name: 2-bromo-N-[7-[(4-methylphenyl)-oxomethyl]-2,3-dihydro-1,4-benzodioxin-6-yl]acetamide IUPAC Name: 2-bromo-N-[7-(4-methylbenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]acetamide Traditional Name: 2-bromo-N-(7-p-toluoyl-2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C18H16BrNO4 MolecularWeight: 390.22794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2NC(=O)CBr)OCCO3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2NC(=O)CBr)OCCO3

InChI

InChI=1S/C18H16BrNO4/c1-11-2-4-12(5-3-11)18(22)13-8-15-16(24-7-6-23-15)9-14(13)20-17(21)10-19/h2-5,8-9H,6-7,10H2,1H3,(H,20,21)