8-[2-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-[2-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-[2-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-[2-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-[N'-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-1,3,7-trimethyl-xanthine Formula: C16H18N6O4 MolecularWeight: 358.35192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NNC=C3C=CC(=O)C(=C3)OC)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1NNC=C3C=CC(=O)C(=C3)OC)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C16H18N6O4/c1-20-12-13(21(2)16(25)22(3)14(12)24)18-15(20)19-17-8-9-5-6-10(23)11(7-9)26-4/h5-8,17H,1-4H3,(H,18,19)