4-(6-chloranylpurin-9-yl)-2-(diethylaminomethyl)phenol hydrochloride

Systemtic Name: 4-(6-chloranylpurin-9-yl)-2-(diethylaminomethyl)phenol hydrochloride Openeye Name: 4-(6-chloropurin-9-yl)-2-(diethylaminomethyl)phenol hydrochloride CAS Name: 4-(6-chloro-9-purinyl)-2-(diethylaminomethyl)phenol hydrochloride IUPAC Name: 4-(6-chloropurin-9-yl)-2-(diethylaminomethyl)phenol hydrochloride Traditional Name: 4-(6-chloropurin-9-yl)-2-(diethylaminomethyl)phenol hydrochloride Formula: C16H19Cl2N5O MolecularWeight: 368.26096

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)N2C=NC3=C2N=CN=C3Cl)O.Cl

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)N2C=NC3=C2N=CN=C3Cl)O.Cl

InChI

InChI=1S/C16H18ClN5O.ClH/c1-3-21(4-2)8-11-7-12(5-6-13(11)23)22-10-20-14-15(17)18-9-19-16(14)22;/h5-7,9-10,23H,3-4,8H2,1-2H3;1H