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

Systemtic Name: 8-[2-[(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-[2-[(3-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-[(3-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-[2-[(3-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-[N'-[(3-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-1,3,7-trimethyl-xanthine Formula: C17H20N6O4 MolecularWeight: 372.3785

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CNNC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C)C=CC1=O

InChI

InChI=1S/C17H20N6O4/c1-5-27-12-8-10(6-7-11(12)24)9-18-20-16-19-14-13(21(16)2)15(25)23(4)17(26)22(14)3/h6-9,18H,5H2,1-4H3,(H,19,20)