5-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butoxy]-2-methyl-1,2,4-triazin-3-one

Systemtic Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butoxy]-2-methyl-1,2,4-triazin-3-one Openeye Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butoxy]-2-methyl-1,2,4-triazin-3-one CAS Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butoxy]-2-methyl-1,2,4-triazin-3-one IUPAC Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butoxy]-2-methyl-1,2,4-triazin-3-one Traditional Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butoxy]-2-methyl-1,2,4-triazin-3-one Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N=C(C=N1)OCCCCNCC2COC3=CC=CC=C3O2

Isomeric SMILES

CN1C(=O)N=C(C=N1)OCCCCNCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H22N4O4/c1-21-17(22)20-16(11-19-21)23-9-5-4-8-18-10-13-12-24-14-6-2-3-7-15(14)25-13/h2-3,6-7,11,13,18H,4-5,8-10,12H2,1H3