2-azanyl-9-(4-oxidanylbut-2-ynyl)-7,8-dihydro-3H-purin-6-one

Systemtic Name: 2-azanyl-9-(4-oxidanylbut-2-ynyl)-7,8-dihydro-3H-purin-6-one Openeye Name: 2-amino-9-(4-hydroxybut-2-ynyl)-7,8-dihydro-3H-purin-6-one CAS Name: 2-amino-9-(4-hydroxybut-2-ynyl)-7,8-dihydro-3H-purin-6-one IUPAC Name: 2-amino-9-(4-hydroxybut-2-ynyl)-7,8-dihydro-3H-purin-6-one Traditional Name: 2-amino-9-(4-hydroxybut-2-ynyl)-7,8-dihydro-3H-purin-6-one Formula: C9H11N5O2 MolecularWeight: 221.21594

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(N1CC#CCO)NC(=NC2=O)N

Isomeric SMILES

C1NC2=C(N1CC#CCO)NC(=NC2=O)N

InChI

InChI=1S/C9H11N5O2/c10-9-12-7-6(8(16)13-9)11-5-14(7)3-1-2-4-15/h11,15H,3-5H2,(H3,10,12,13,16)