3-(ethylamino)-2-(3-methoxy-4-phenylmethoxy-phenyl)-4-oxidanyl-3-purin-9-yl-oxolane-2-carboxylic acid

Systemtic Name: 3-(ethylamino)-2-(3-methoxy-4-phenylmethoxy-phenyl)-4-oxidanyl-3-purin-9-yl-oxolane-2-carboxylic acid Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)-3-(ethylamino)-4-hydroxy-3-purin-9-yl-tetrahydrofuran-2-carboxylic acid CAS Name: 3-(ethylamino)-4-hydroxy-2-(3-methoxy-4-phenylmethoxyphenyl)-3-(9-purinyl)-2-oxolanecarboxylic acid IUPAC Name: 3-(ethylamino)-4-hydroxy-2-(3-methoxy-4-phenylmethoxyphenyl)-3-purin-9-yloxolane-2-carboxylic acid Traditional Name: 2-(4-benzoxy-3-methoxy-phenyl)-3-(ethylamino)-4-hydroxy-3-purin-9-yl-tetrahydrofuran-2-carboxylic acid Formula: C26H27N5O6 MolecularWeight: 505.52248

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1(C(COC1(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)O)O)N4C=NC5=CN=CN=C54

Isomeric SMILES

CCNC1(C(COC1(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)O)O)N4C=NC5=CN=CN=C54

InChI

InChI=1S/C26H27N5O6/c1-3-30-26(31-16-29-19-12-27-15-28-23(19)31)22(32)14-37-25(26,24(33)34)18-9-10-20(21(11-18)35-2)36-13-17-7-5-4-6-8-17/h4-12,15-16,22,30,32H,3,13-14H2,1-2H3,(H,33,34)