9-[(1R,3S)-1-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-3-oxidanyl-cyclopentyl]-3H-purin-6-one

Systemtic Name: 9-[(1R,3S)-1-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-3-oxidanyl-cyclopentyl]-3H-purin-6-one Openeye Name: 9-[(1R,3S)-3-hydroxy-1-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]cyclopentyl]-3H-purin-6-one CAS Name: 9-[(1R,3S)-3-hydroxy-1-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]cyclopentyl]-3H-purin-6-one IUPAC Name: 9-[(1R,3S)-3-hydroxy-1-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]cyclopentyl]-3H-purin-6-one Traditional Name: 9-[(1R,3S)-3-hydroxy-1-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]cyclopentyl]-3H-purin-6-one Formula: C31H30N4O4 MolecularWeight: 522.5943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC4(CCC(C4)O)N5C=NC6=C5NC=NC6=O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC[C@]4(CC[C@@H](C4)O)N5C=NC6=C5NC=NC6=O

InChI

InChI=1S/C31H30N4O4/c1-38-26-14-12-24(13-15-26)31(22-8-4-2-5-9-22,23-10-6-3-7-11-23)39-19-30(17-16-25(36)18-30)35-21-34-27-28(35)32-20-33-29(27)37/h2-15,20-21,25,36H,16-19H2,1H3,(H,32,33,37)/t25-,30+/m0/s1