1-(6-aminopurin-9-yl)-4-phenylmethoxy-butan-2-one

Systemtic Name: 1-(6-aminopurin-9-yl)-4-phenylmethoxy-butan-2-one Openeye Name: 1-(6-aminopurin-9-yl)-4-benzyloxy-butan-2-one CAS Name: 1-(6-aminopurin-9-yl)-4-phenylmethoxy-2-butanone IUPAC Name: 1-(6-aminopurin-9-yl)-4-phenylmethoxybutan-2-one Traditional Name: 1-adenin-9-yl-4-benzoxy-butan-2-one Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCC(=O)CN2C=NC3=C2N=CN=C3N

Isomeric SMILES

C1=CC=C(C=C1)COCCC(=O)CN2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C16H17N5O2/c17-15-14-16(19-10-18-15)21(11-20-14)8-13(22)6-7-23-9-12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H2,17,18,19)