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

Systemtic Name: 8-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,3-dipropyl-7,9-dihydropurine-2,6-dione Openeye Name: 8-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3-dipropyl-7,9-dihydropurine-2,6-dione CAS Name: 8-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,3-dipropyl-7,9-dihydropurine-2,6-dione IUPAC Name: 8-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3-dipropyl-7,9-dihydropurine-2,6-dione Traditional Name: 8-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,3-dipropyl-7,9-dihydropurine-2,6-quinone Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=C3C=CC(=O)C=C3)N2

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=C3C=CC(=O)C=C3)N2

InChI

InChI=1S/C17H20N4O3/c1-3-9-20-15-13(16(23)21(10-4-2)17(20)24)18-14(19-15)11-5-7-12(22)8-6-11/h5-8,18-19H,3-4,9-10H2,1-2H3