2-(2,3-dihydro-1H-inden-5-ylamino)-9-(2-hydroxyethyl)-3H-purin-6-one

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylamino)-9-(2-hydroxyethyl)-3H-purin-6-one Openeye Name: 9-(2-hydroxyethyl)-2-(indan-5-ylamino)-3H-purin-6-one CAS Name: 2-(2,3-dihydro-1H-inden-5-ylamino)-9-(2-hydroxyethyl)-3H-purin-6-one IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylamino)-9-(2-hydroxyethyl)-3H-purin-6-one Traditional Name: 9-(2-hydroxyethyl)-2-(indan-5-ylamino)-3H-purin-6-one Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC3=NC(=O)C4=C(N3)N(C=N4)CCO

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC3=NC(=O)C4=C(N3)N(C=N4)CCO

InChI

InChI=1S/C16H17N5O2/c22-7-6-21-9-17-13-14(21)19-16(20-15(13)23)18-12-5-4-10-2-1-3-11(10)8-12/h4-5,8-9,22H,1-3,6-7H2,(H2,18,19,20,23)