3-(6-aminopurin-9-yl)undecan-2-one

Systemtic Name: 3-(6-aminopurin-9-yl)undecan-2-one Openeye Name: 3-(6-aminopurin-9-yl)undecan-2-one CAS Name: 3-(6-aminopurin-9-yl)-2-undecanone IUPAC Name: 3-(6-aminopurin-9-yl)undecan-2-one Traditional Name: 3-adenin-9-ylundecan-2-one Formula: C16H25N5O MolecularWeight: 303.4026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)C)N1C=NC2=C1N=CN=C2N

Isomeric SMILES

CCCCCCCCC(C(=O)C)N1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C16H25N5O/c1-3-4-5-6-7-8-9-13(12(2)22)21-11-20-14-15(17)18-10-19-16(14)21/h10-11,13H,3-9H2,1-2H3,(H2,17,18,19)