3-methyl-8-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-propyl-7,9-dihydropurine-2,6-dione

Systemtic Name: 3-methyl-8-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-propyl-7,9-dihydropurine-2,6-dione Openeye Name: 3-methyl-8-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-propyl-7,9-dihydropurine-2,6-dione CAS Name: 3-methyl-8-(4-oxo-1-cyclohexa-2,5-dienylidene)-1-propyl-7,9-dihydropurine-2,6-dione IUPAC Name: 3-methyl-8-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-propyl-7,9-dihydropurine-2,6-dione Traditional Name: 8-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-methyl-1-propyl-7,9-dihydropurine-2,6-quinone Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(NC(=C3C=CC(=O)C=C3)N2)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(NC(=C3C=CC(=O)C=C3)N2)N(C1=O)C

InChI

InChI=1S/C15H16N4O3/c1-3-8-19-14(21)11-13(18(2)15(19)22)17-12(16-11)9-4-6-10(20)7-5-9/h4-7,16-17H,3,8H2,1-2H3