N,N-dimethyl-9-[(3-phenylmethoxyphenyl)methyl]purin-6-amine

Systemtic Name: N,N-dimethyl-9-[(3-phenylmethoxyphenyl)methyl]purin-6-amine Openeye Name: 9-[(3-benzyloxyphenyl)methyl]-N,N-dimethyl-purin-6-amine CAS Name: N,N-dimethyl-9-[(3-phenylmethoxyphenyl)methyl]-6-purinamine IUPAC Name: N,N-dimethyl-9-[(3-phenylmethoxyphenyl)methyl]purin-6-amine Traditional Name: [9-(3-benzoxybenzyl)purin-6-yl]-dimethyl-amine Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C21H21N5O/c1-25(2)20-19-21(23-14-22-20)26(15-24-19)12-17-9-6-10-18(11-17)27-13-16-7-4-3-5-8-16/h3-11,14-15H,12-13H2,1-2H3