4-[[9-(4-chloranylbutyl)purin-6-yl]amino]-2-methoxy-phenol

Systemtic Name: 4-[[9-(4-chloranylbutyl)purin-6-yl]amino]-2-methoxy-phenol Openeye Name: 4-[[9-(4-chlorobutyl)purin-6-yl]amino]-2-methoxy-phenol CAS Name: 4-[[9-(4-chlorobutyl)-6-purinyl]amino]-2-methoxyphenol IUPAC Name: 4-[[9-(4-chlorobutyl)purin-6-yl]amino]-2-methoxyphenol Traditional Name: 4-[[9-(4-chlorobutyl)purin-6-yl]amino]-2-methoxy-phenol Formula: C16H18ClN5O2 MolecularWeight: 347.79942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NC=NC3=C2N=CN3CCCCCl)O

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NC=NC3=C2N=CN3CCCCCl)O

InChI

InChI=1S/C16H18ClN5O2/c1-24-13-8-11(4-5-12(13)23)21-15-14-16(19-9-18-15)22(10-20-14)7-3-2-6-17/h4-5,8-10,23H,2-3,6-7H2,1H3,(H,18,19,21)