(3R,4R)-4-[2-chloranyl-6-(2,2-diphenylethylamino)purin-9-yl]-3-oxidanyl-cyclopentene-1-carbaldehyde

Systemtic Name: (3R,4R)-4-[2-chloranyl-6-(2,2-diphenylethylamino)purin-9-yl]-3-oxidanyl-cyclopentene-1-carbaldehyde Openeye Name: (3R,4R)-4-[2-chloro-6-(2,2-diphenylethylamino)purin-9-yl]-3-hydroxy-cyclopentene-1-carbaldehyde CAS Name: (3R,4R)-4-[2-chloro-6-(2,2-diphenylethylamino)-9-purinyl]-3-hydroxy-1-cyclopentenecarboxaldehyde IUPAC Name: (3R,4R)-4-[2-chloro-6-(2,2-diphenylethylamino)purin-9-yl]-3-hydroxycyclopentene-1-carbaldehyde Traditional Name: (3R,4R)-4-[2-chloro-6-(2,2-diphenylethylamino)purin-9-yl]-3-hydroxy-cyclopentene-1-carbaldehyde Formula: C25H22ClN5O2 MolecularWeight: 459.92748

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C=C1C=O)O)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1[C@H]([C@@H](C=C1C=O)O)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C25H22ClN5O2/c26-25-29-23(22-24(30-25)31(15-28-22)20-11-16(14-32)12-21(20)33)27-13-19(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,12,14-15,19-21,33H,11,13H2,(H,27,29,30)/t20-,21-/m1/s1