1-(1,3-benzodioxol-5-ylmethyl)-7-methyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-dione

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-7-methyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-dione Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-7-methyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-dione CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-7-methyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-dione IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-7-methyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-dione Traditional Name: 7-methyl-1-piperonyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-quinone Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=O)N1)C(=O)NN=C2CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC2=C(C(=O)N1)C(=O)NN=C2CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H13N3O4/c1-8-4-10-11(18-19-16(21)14(10)15(20)17-8)5-9-2-3-12-13(6-9)23-7-22-12/h2-4,6H,5,7H2,1H3,(H,17,20)(H,19,21)