(2R,3S,4R)-2-(hydroxymethyl)-5-[6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)purin-9-yl]oxolane-3,4-diol

Systemtic Name: (2R,3S,4R)-2-(hydroxymethyl)-5-[6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)purin-9-yl]oxolane-3,4-diol Openeye Name: (2R,3S,4R)-2-(hydroxymethyl)-5-[6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: (2R,3S,4R)-2-(hydroxymethyl)-5-[6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)-9-purinyl]oxolane-3,4-diol IUPAC Name: (2R,3S,4R)-2-(hydroxymethyl)-5-[6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)purin-9-yl]oxolane-3,4-diol Traditional Name: (2R,3S,4R)-2-methylol-5-[6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)purin-9-yl]tetrahydrofuran-3,4-diol Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2CN(C1)C3=NC=NC4=C3N=CN4C5C(C(C(O5)CO)O)O

Isomeric SMILES

C1CC2=CC=CC=C2CN(C1)C3=NC=NC4=C3N=CN4C5[C@@H]([C@@H]([C@H](O5)CO)O)O

InChI

InChI=1S/C20H23N5O4/c26-9-14-16(27)17(28)20(29-14)25-11-23-15-18(21-10-22-19(15)25)24-7-3-6-12-4-1-2-5-13(12)8-24/h1-2,4-5,10-11,14,16-17,20,26-28H,3,6-9H2/t14-,16-,17-,20?/m1/s1