5-(6-aminopurin-9-yl)-2-(3H-inden-1-ylmethoxymethyl)-4-methoxy-oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-2-(3H-inden-1-ylmethoxymethyl)-4-methoxy-oxolan-3-ol Openeye Name: 5-(6-aminopurin-9-yl)-2-(3H-inden-1-ylmethoxymethyl)-4-methoxy-tetrahydrofuran-3-ol CAS Name: 5-(6-aminopurin-9-yl)-2-(3H-inden-1-ylmethoxymethyl)-4-methoxy-3-oxolanol IUPAC Name: 5-(6-aminopurin-9-yl)-2-(3H-inden-1-ylmethoxymethyl)-4-methoxyoxolan-3-ol Traditional Name: 5-adenin-9-yl-2-(3H-inden-1-ylmethoxymethyl)-4-methoxy-tetrahydrofuran-3-ol Formula: C21H23N5O4 MolecularWeight: 409.43842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(OC1N2C=NC3=C2N=CN=C3N)COCC4=CCC5=CC=CC=C54)O

Isomeric SMILES

COC1C(C(OC1N2C=NC3=C2N=CN=C3N)COCC4=CCC5=CC=CC=C54)O

InChI

InChI=1S/C21H23N5O4/c1-28-18-17(27)15(9-29-8-13-7-6-12-4-2-3-5-14(12)13)30-21(18)26-11-25-16-19(22)23-10-24-20(16)26/h2-5,7,10-11,15,17-18,21,27H,6,8-9H2,1H3,(H2,22,23,24)