methyl 2-[6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]ethanoate

Systemtic Name: methyl 2-[6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]ethanoate Openeye Name: methyl 2-[6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]acetate CAS Name: 2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]-9-purinyl]acetic acid methyl ester IUPAC Name: methyl 2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]acetate Traditional Name: 2-[6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]acetic acid methyl ester Formula: C28H25N5O3 MolecularWeight: 479.5298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC=NC5=C4N=CN5CC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC=NC5=C4N=CN5CC(=O)OC

InChI

InChI=1S/C28H25N5O3/c1-35-23-15-13-22(14-16-23)28(20-9-5-3-6-10-20,21-11-7-4-8-12-21)32-26-25-27(30-18-29-26)33(19-31-25)17-24(34)36-2/h3-16,18-19H,17H2,1-2H3,(H,29,30,32)