9-(4-azanylcyclohexyl)-2-(3-hydroxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(4-azanylcyclohexyl)-2-(3-hydroxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(4-aminocyclohexyl)-2-(3-hydroxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(4-aminocyclohexyl)-2-(3-hydroxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(4-aminocyclohexyl)-2-(3-hydroxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(4-aminocyclohexyl)-2-(3-hydroxyphenyl)-8-keto-7H-purine-6-carboxamide Formula: C18H20N6O3 MolecularWeight: 368.3898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=CC=C4)O

Isomeric SMILES

C1CC(CCC1N)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=CC=C4)O

InChI

InChI=1S/C18H20N6O3/c19-10-4-6-11(7-5-10)24-17-14(22-18(24)27)13(15(20)26)21-16(23-17)9-2-1-3-12(25)8-9/h1-3,8,10-11,25H,4-7,19H2,(H2,20,26)(H,22,27)