[(1R,2R,4R,5R)-4-(6-aminopurin-9-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl N-(phenylmethyl)carbamate

Systemtic Name: [(1R,2R,4R,5R)-4-(6-aminopurin-9-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl N-(phenylmethyl)carbamate Openeye Name: [(1R,2R,4R,5R)-4-(6-aminopurin-9-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [(1R,2R,4R,5R)-4-(6-aminopurin-9-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl ester IUPAC Name: [(1R,2R,4R,5R)-4-(6-aminopurin-9-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [(1R,2R,4R,5R)-4-adenin-9-yl-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl ester Formula: C18H18N6O4 MolecularWeight: 382.37332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)OCC2C3C(O3)C(O2)N4C=NC5=C4N=CN=C5N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)OC[C@@H]2[C@@H]3[C@@H](O3)[C@@H](O2)N4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C18H18N6O4/c19-15-12-16(22-8-21-15)24(9-23-12)17-14-13(28-14)11(27-17)7-26-18(25)20-6-10-4-2-1-3-5-10/h1-5,8-9,11,13-14,17H,6-7H2,(H,20,25)(H2,19,21,22)/t11-,13-,14-,17-/m1/s1