N-(4-bromanyl-3-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-amino]ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-amino]ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-ethyl-amino]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylamino]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylamino]acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-ethyl-amino]acetamide Formula: C21H24BrN3O4 MolecularWeight: 462.33696

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC(=C(C=C1)Br)C)CC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCN(CC(=O)NC1=CC(=C(C=C1)Br)C)CC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H24BrN3O4/c1-3-25(12-20(26)23-15-4-6-17(22)14(2)10-15)13-21(27)24-16-5-7-18-19(11-16)29-9-8-28-18/h4-7,10-11H,3,8-9,12-13H2,1-2H3,(H,23,26)(H,24,27)