4-(6-aminopurin-9-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

Systemtic Name: 4-(6-aminopurin-9-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Openeye Name: 4-(6-aminopurin-9-yl)-2-(tert-butoxycarbonylamino)butanoic acid CAS Name: 4-(6-aminopurin-9-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid IUPAC Name: 4-(6-aminopurin-9-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Traditional Name: 4-adenin-9-yl-2-(tert-butoxycarbonylamino)butyric acid Formula: C14H20N6O4 MolecularWeight: 336.3464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCN1C=NC2=C1N=CN=C2N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCN1C=NC2=C1N=CN=C2N)C(=O)O

InChI

InChI=1S/C14H20N6O4/c1-14(2,3)24-13(23)19-8(12(21)22)4-5-20-7-18-9-10(15)16-6-17-11(9)20/h6-8H,4-5H2,1-3H3,(H,19,23)(H,21,22)(H2,15,16,17)