2-(diethylaminomethyl)-4-(7H-purin-6-ylamino)phenol hydrochloride

Systemtic Name: 2-(diethylaminomethyl)-4-(7H-purin-6-ylamino)phenol hydrochloride Openeye Name: 2-(diethylaminomethyl)-4-(7H-purin-6-ylamino)phenol hydrochloride CAS Name: 2-(diethylaminomethyl)-4-(7H-purin-6-ylamino)phenol hydrochloride IUPAC Name: 2-(diethylaminomethyl)-4-(7H-purin-6-ylamino)phenol hydrochloride Traditional Name: 2-(diethylaminomethyl)-4-(7H-purin-6-ylamino)phenol hydrochloride Formula: C16H21ClN6O MolecularWeight: 348.83054

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)NC2=NC=NC3=C2NC=N3)O.Cl

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)NC2=NC=NC3=C2NC=N3)O.Cl

InChI

InChI=1S/C16H20N6O.ClH/c1-3-22(4-2)8-11-7-12(5-6-13(11)23)21-16-14-15(18-9-17-14)19-10-20-16;/h5-7,9-10,23H,3-4,8H2,1-2H3,(H2,17,18,19,20,21);1H