[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-oxidanyl-propyl] pentanoate

Systemtic Name: [2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-oxidanyl-propyl] pentanoate Openeye Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxy-propyl] pentanoate CAS Name: pentanoic acid [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] ester IUPAC Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] pentanoate Traditional Name: valeric acid [2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]-3-hydroxy-propyl] ester Formula: C14H21N5O5 MolecularWeight: 339.34704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC(CO)OCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CCCCC(=O)OCC(CO)OCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C14H21N5O5/c1-2-3-4-10(21)23-6-9(5-20)24-8-19-7-16-11-12(19)17-14(15)18-13(11)22/h7,9,20H,2-6,8H2,1H3,(H3,15,17,18,22)