9-[[(2R,3S,4S)-3,4-bis(phenylmethoxymethyl)oxetan-2-yl]methyl]purin-6-amine

Systemtic Name: 9-[[(2R,3S,4S)-3,4-bis(phenylmethoxymethyl)oxetan-2-yl]methyl]purin-6-amine Openeye Name: 9-[[(2R,3S,4S)-3,4-bis(benzyloxymethyl)oxetan-2-yl]methyl]purin-6-amine CAS Name: 9-[[(2R,3S,4S)-3,4-bis(phenylmethoxymethyl)-2-oxetanyl]methyl]-6-purinamine IUPAC Name: 9-[[(2R,3S,4S)-3,4-bis(phenylmethoxymethyl)oxetan-2-yl]methyl]purin-6-amine Traditional Name: [9-[[(2R,3S,4S)-3,4-bis(benzoxymethyl)oxetan-2-yl]methyl]purin-6-yl]amine Formula: C25H27N5O3 MolecularWeight: 445.51358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C(OC2COCC3=CC=CC=C3)CN4C=NC5=C4N=CN=C5N

Isomeric SMILES

C1=CC=C(C=C1)COC[C@H]2[C@@H](O[C@@H]2COCC3=CC=CC=C3)CN4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C25H27N5O3/c26-24-23-25(28-16-27-24)30(17-29-23)11-21-20(14-31-12-18-7-3-1-4-8-18)22(33-21)15-32-13-19-9-5-2-6-10-19/h1-10,16-17,20-22H,11-15H2,(H2,26,27,28)/t20-,21-,22+/m0/s1