2-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-8-(3-oxidanylcyclopentyl)-3,7-dihydropurin-6-one

Systemtic Name: 2-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-8-(3-oxidanylcyclopentyl)-3,7-dihydropurin-6-one Openeye Name: 8-(3-hydroxycyclopentyl)-2-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-3,7-dihydropurin-6-one CAS Name: 8-(3-hydroxycyclopentyl)-2-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-3,7-dihydropurin-6-one IUPAC Name: 8-(3-hydroxycyclopentyl)-2-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-3,7-dihydropurin-6-one Traditional Name: 8-(3-hydroxycyclopentyl)-2-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-3,7-dihydropurin-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=NC(=O)C5=C(N4)N=C(N5)C6CCC(C6)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC4=NC(=O)C5=C(N4)N=C(N5)C6CCC(C6)O

InChI

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