9-[(1R,4R,5R,6R)-5,6-bis(phenylmethoxy)-4-(phenylmethoxymethyl)cyclohex-2-en-1-yl]purin-6-amine

Systemtic Name: 9-[(1R,4R,5R,6R)-5,6-bis(phenylmethoxy)-4-(phenylmethoxymethyl)cyclohex-2-en-1-yl]purin-6-amine Openeye Name: 9-[(1R,4R,5R,6R)-5,6-dibenzyloxy-4-(benzyloxymethyl)cyclohex-2-en-1-yl]purin-6-amine CAS Name: 9-[(1R,4R,5R,6R)-5,6-bis(phenylmethoxy)-4-(phenylmethoxymethyl)-1-cyclohex-2-enyl]-6-purinamine IUPAC Name: 9-[(1R,4R,5R,6R)-5,6-bis(phenylmethoxy)-4-(phenylmethoxymethyl)cyclohex-2-en-1-yl]purin-6-amine Traditional Name: [9-[(1R,4R,5R,6R)-5,6-dibenzoxy-4-(benzoxymethyl)cyclohex-2-en-1-yl]purin-6-yl]amine Formula: C33H33N5O3 MolecularWeight: 547.64682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C=CC(C(C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)N5C=NC6=C5N=CN=C6N

Isomeric SMILES

C1=CC=C(C=C1)COC[C@H]2C=C[C@H]([C@H]([C@@H]2OCC3=CC=CC=C3)OCC4=CC=CC=C4)N5C=NC6=C5N=CN=C6N

InChI

InChI=1S/C33H33N5O3/c34-32-29-33(36-22-35-32)38(23-37-29)28-17-16-27(21-39-18-24-10-4-1-5-11-24)30(40-19-25-12-6-2-7-13-25)31(28)41-20-26-14-8-3-9-15-26/h1-17,22-23,27-28,30-31H,18-21H2,(H2,34,35,36)/t27-,28-,30-,31-/m1/s1