2-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-phenylmethoxy-purin-9-yl]ethanoic acid

Systemtic Name: 2-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-phenylmethoxy-purin-9-yl]ethanoic acid Openeye Name: 2-[6-benzyloxy-2-[bis(tert-butoxycarbonyl)amino]purin-9-yl]acetic acid CAS Name: 2-[2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-phenylmethoxy-9-purinyl]acetic acid IUPAC Name: 2-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-phenylmethoxypurin-9-yl]acetic acid Traditional Name: 2-[6-benzoxy-2-[bis(tert-butoxycarbonyl)amino]purin-9-yl]acetic acid Formula: C24H29N5O7 MolecularWeight: 499.51636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=NC2=C(C(=N1)OCC3=CC=CC=C3)N=CN2CC(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=NC2=C(C(=N1)OCC3=CC=CC=C3)N=CN2CC(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H29N5O7/c1-23(2,3)35-21(32)29(22(33)36-24(4,5)6)20-26-18-17(25-14-28(18)12-16(30)31)19(27-20)34-13-15-10-8-7-9-11-15/h7-11,14H,12-13H2,1-6H3,(H,30,31)