9-[2-[bis(2-hydroxyethyl)amino]ethyl]-3H-purin-6-one hydrochloride

Systemtic Name: 9-[2-[bis(2-hydroxyethyl)amino]ethyl]-3H-purin-6-one hydrochloride Openeye Name: 9-[2-[bis(2-hydroxyethyl)amino]ethyl]-3H-purin-6-one hydrochloride CAS Name: 9-[2-[bis(2-hydroxyethyl)amino]ethyl]-3H-purin-6-one hydrochloride IUPAC Name: 9-[2-[bis(2-hydroxyethyl)amino]ethyl]-3H-purin-6-one hydrochloride Traditional Name: 9-[2-[bis(2-hydroxyethyl)amino]ethyl]-3H-purin-6-one hydrochloride Formula: C11H18ClN5O3 MolecularWeight: 303.74532

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)CCN(CCO)CCO.Cl

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)CCN(CCO)CCO.Cl

InChI

InChI=1S/C11H17N5O3.ClH/c17-5-3-15(4-6-18)1-2-16-8-14-9-10(16)12-7-13-11(9)19;/h7-8,17-18H,1-6H2,(H,12,13,19);1H