9-[[2-(phenylmethoxymethyl)cyclobuten-1-yl]methyl]purin-6-amine

Systemtic Name: 9-[[2-(phenylmethoxymethyl)cyclobuten-1-yl]methyl]purin-6-amine Openeye Name: 9-[[2-(benzyloxymethyl)cyclobuten-1-yl]methyl]purin-6-amine CAS Name: 9-[[2-(phenylmethoxymethyl)-1-cyclobutenyl]methyl]-6-purinamine IUPAC Name: 9-[[2-(phenylmethoxymethyl)cyclobuten-1-yl]methyl]purin-6-amine Traditional Name: [9-[[2-(benzoxymethyl)cyclobuten-1-yl]methyl]purin-6-yl]amine Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C1CN2C=NC3=C2N=CN=C3N)COCC4=CC=CC=C4

Isomeric SMILES

C1CC(=C1CN2C=NC3=C2N=CN=C3N)COCC4=CC=CC=C4

InChI

InChI=1S/C18H19N5O/c19-17-16-18(21-11-20-17)23(12-22-16)8-14-6-7-15(14)10-24-9-13-4-2-1-3-5-13/h1-5,11-12H,6-10H2,(H2,19,20,21)