8-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-(4-methoxyphenyl)-1-methyl-7,9-dihydropurine-2,6-dione

Systemtic Name: 8-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-(4-methoxyphenyl)-1-methyl-7,9-dihydropurine-2,6-dione Openeye Name: 8-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-(4-methoxyphenyl)-1-methyl-7,9-dihydropurine-2,6-dione CAS Name: 8-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-3-(4-methoxyphenyl)-1-methyl-7,9-dihydropurine-2,6-dione IUPAC Name: 8-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-3-(4-methoxyphenyl)-1-methyl-7,9-dihydropurine-2,6-dione Traditional Name: 8-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-3-(4-methoxyphenyl)-1-methyl-7,9-dihydropurine-2,6-quinone Formula: C27H32N4O4 MolecularWeight: 476.56738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NC3=C(N2)N(C(=O)N(C3=O)C)C4=CC=C(C=C4)OC)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2NC3=C(N2)N(C(=O)N(C3=O)C)C4=CC=C(C=C4)OC)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C27H32N4O4/c1-26(2,3)18-13-15(14-19(21(18)32)27(4,5)6)22-28-20-23(29-22)31(25(34)30(7)24(20)33)16-9-11-17(35-8)12-10-16/h9-14,28-29H,1-8H3