(2R)-2-[2-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)ethylamino]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[2-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)ethylamino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]-3-methyl-butanoic acid CAS Name: (2R)-2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]-3-methylbutanoic acid Traditional Name: (2R)-2-[2-(6-amino-2-butoxy-8-keto-7H-purin-9-yl)ethylamino]-3-methyl-butyric acid Formula: C16H26N6O4 MolecularWeight: 366.41544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCNC(C(C)C)C(=O)O

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCN[C@H](C(C)C)C(=O)O

InChI

InChI=1S/C16H26N6O4/c1-4-5-8-26-15-20-12(17)11-13(21-15)22(16(25)19-11)7-6-18-10(9(2)3)14(23)24/h9-10,18H,4-8H2,1-3H3,(H,19,25)(H,23,24)(H2,17,20,21)/t10-/m1/s1