1-methyl-3-(4-methylperoxybuta-2,3-dienyl)pteridine-2,4-dione

Systemtic Name: 1-methyl-3-(4-methylperoxybuta-2,3-dienyl)pteridine-2,4-dione Openeye Name: 1-methyl-3-(4-methylperoxybuta-2,3-dienyl)pteridine-2,4-dione CAS Name: 1-methyl-3-(4-methyldioxybuta-2,3-dienyl)pteridine-2,4-dione IUPAC Name: 1-methyl-3-(4-methylperoxybuta-2,3-dienyl)pteridine-2,4-dione Traditional Name: 1-methyl-3-(4-methylperoxybuta-2,3-dienyl)pteridine-2,4-quinone Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=CN=C2C(=O)N(C1=O)CC=C=COOC

Isomeric SMILES

CN1C2=NC=CN=C2C(=O)N(C1=O)CC=C=COOC

InChI

InChI=1S/C12H12N4O4/c1-15-10-9(13-5-6-14-10)11(17)16(12(15)18)7-3-4-8-20-19-2/h3,5-6,8H,7H2,1-2H3