(3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-bis(oxidanyl)cyclopentene-1-carbonitrile

Systemtic Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-bis(oxidanyl)cyclopentene-1-carbonitrile Openeye Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-dihydroxy-cyclopentene-1-carbonitrile CAS Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-dihydroxy-1-cyclopentenecarbonitrile IUPAC Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-dihydroxycyclopentene-1-carbonitrile Traditional Name: (3R,4S,5R)-3-adenin-9-yl-4,5-dihydroxy-cyclopentene-1-carbonitrile Formula: C11H10N6O2 MolecularWeight: 258.2361

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(C(C1N2C=NC3=C2N=CN=C3N)O)O)C#N

Isomeric SMILES

C1=C([C@H]([C@H]([C@@H]1N2C=NC3=C2N=CN=C3N)O)O)C#N

InChI

InChI=1S/C11H10N6O2/c12-2-5-1-6(9(19)8(5)18)17-4-16-7-10(13)14-3-15-11(7)17/h1,3-4,6,8-9,18-19H,(H2,13,14,15)/t6-,8-,9+/m1/s1