[2-[(2-azanylpurin-7-yl)methoxy]-3-oxidanyl-propyl] cyclohexanecarboxylate

Systemtic Name: [2-[(2-azanylpurin-7-yl)methoxy]-3-oxidanyl-propyl] cyclohexanecarboxylate Openeye Name: [2-[(2-aminopurin-7-yl)methoxy]-3-hydroxy-propyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [2-[(2-amino-7-purinyl)methoxy]-3-hydroxypropyl] ester IUPAC Name: [2-[(2-aminopurin-7-yl)methoxy]-3-hydroxypropyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [2-[(2-aminopurin-7-yl)methoxy]-3-hydroxy-propyl] ester Formula: C16H23N5O4 MolecularWeight: 349.38492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OCC(CO)OCN2C=NC3=NC(=NC=C32)N

Isomeric SMILES

C1CCC(CC1)C(=O)OCC(CO)OCN2C=NC3=NC(=NC=C32)N

InChI

InChI=1S/C16H23N5O4/c17-16-18-6-13-14(20-16)19-9-21(13)10-25-12(7-22)8-24-15(23)11-4-2-1-3-5-11/h6,9,11-12,22H,1-5,7-8,10H2,(H2,17,18,20)