2-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butyl]-4-methyl-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butyl]-4-methyl-1,2,4-triazine-3,5-dione Openeye Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butyl]-4-methyl-1,2,4-triazine-3,5-dione CAS Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butyl]-4-methyl-1,2,4-triazine-3,5-dione IUPAC Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butyl]-4-methyl-1,2,4-triazine-3,5-dione Traditional Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butyl]-4-methyl-1,2,4-triazine-3,5-quinone Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=NN(C1=O)CCCCNCC2COC3=CC=CC=C3O2

Isomeric SMILES

CN1C(=O)C=NN(C1=O)CCCCNCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H22N4O4/c1-20-16(22)11-19-21(17(20)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