4-[(6-azanyl-2-butoxy-purin-9-yl)methyl]phenol

Systemtic Name: 4-[(6-azanyl-2-butoxy-purin-9-yl)methyl]phenol Openeye Name: 4-[(6-amino-2-butoxy-purin-9-yl)methyl]phenol CAS Name: 4-[(6-amino-2-butoxy-9-purinyl)methyl]phenol IUPAC Name: 4-[(6-amino-2-butoxypurin-9-yl)methyl]phenol Traditional Name: 4-[(6-amino-2-butoxy-purin-9-yl)methyl]phenol Formula: C16H19N5O2 MolecularWeight: 313.35436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CC=C(C=C3)O

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CC=C(C=C3)O

InChI

InChI=1S/C16H19N5O2/c1-2-3-8-23-16-19-14(17)13-15(20-16)21(10-18-13)9-11-4-6-12(22)7-5-11/h4-7,10,22H,2-3,8-9H2,1H3,(H2,17,19,20)