2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3,7-dihydropurin-6-one

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3,7-dihydropurin-6-one Openeye Name: 2-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3,7-dihydropurin-6-one CAS Name: 2-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-3,7-dihydropurin-6-one IUPAC Name: 2-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-3,7-dihydropurin-6-one Traditional Name: 2-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-3,7-dihydropurin-6-one Formula: C19H24N4O2 MolecularWeight: 340.41946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NC3=C(C(=O)N2)NC=N3)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2NC3=C(C(=O)N2)NC=N3)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C19H24N4O2/c1-18(2,3)11-7-10(8-12(14(11)24)19(4,5)6)15-22-16-13(17(25)23-15)20-9-21-16/h7-9,22H,1-6H3,(H,20,21)(H,23,25)