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6-[(4-oxidanylcyclohexyl)amino]-2-phenyl-7H-purine-8-carboxylic acid

6-[(4-oxidanylcyclohexyl)amino]-2-phenyl-7H-purine-8-carboxylic acid

Systemtic Name:6-[(4-oxidanylcyclohexyl)amino]-2-phenyl-7H-purine-8-carboxylic acid
Openeye Name:6-[(4-hydroxycyclohexyl)amino]-2-phenyl-7H-purine-8-carboxylic acid
CAS Name:6-[(4-hydroxycyclohexyl)amino]-2-phenyl-7H-purine-8-carboxylic acid
IUPAC Name:6-[(4-hydroxycyclohexyl)amino]-2-phenyl-7H-purine-8-carboxylic acid
Traditional Name:6-[(4-hydroxycyclohexyl)amino]-2-phenyl-7H-purine-8-carboxylic acid
Formula: C18H19N5O3
MolecularWeight: 353.37516
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC(=NC3=C2NC(=N3)C(=O)O)C4=CC=CC=C4)O


Isomeric SMILES

C1CC(CCC1NC2=NC(=NC3=C2NC(=N3)C(=O)O)C4=CC=CC=C4)O


InChI

InChI=1S/C18H19N5O3/c24-12-8-6-11(7-9-12)19-15-13-16(23-17(20-13)18(25)26)22-14(21-15)10-4-2-1-3-5-10/h1-5,11-12,24H,6-9H2,(H,25,26)(H2,19,20,21,22,23)


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