4-[3-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]-2-(4-oxidanyl-4-oxidanylidene-butoxy)propoxy]butanoic acid

Systemtic Name: 4-[3-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]-2-(4-oxidanyl-4-oxidanylidene-butoxy)propoxy]butanoic acid Openeye Name: 4-[3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]-2-(4-hydroxy-4-oxo-butoxy)propoxy]butanoic acid CAS Name: 4-[3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]-2-(4-hydroxy-4-oxobutoxy)propoxy]butanoic acid IUPAC Name: 4-[3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]-2-(4-hydroxy-4-oxobutoxy)propoxy]butanoic acid Traditional Name: 4-[3-[(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)methoxy]-2-(4-hydroxy-4-keto-butoxy)propoxy]butyric acid Formula: C17H27N5O8 MolecularWeight: 429.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(N1COCC(COCCCC(=O)O)OCCCC(=O)O)NC(=NC2=O)N

Isomeric SMILES

C1NC2=C(N1COCC(COCCCC(=O)O)OCCCC(=O)O)NC(=NC2=O)N

InChI

InChI=1S/C17H27N5O8/c18-17-20-15-14(16(27)21-17)19-9-22(15)10-29-8-11(30-6-2-4-13(25)26)7-28-5-1-3-12(23)24/h11,19H,1-10H2,(H,23,24)(H,25,26)(H3,18,20,21,27)