2-azanyl-7-(2-phenyl-2-prop-2-enoxy-ethyl)-3H-purin-6-one

Systemtic Name: 2-azanyl-7-(2-phenyl-2-prop-2-enoxy-ethyl)-3H-purin-6-one Openeye Name: 7-(2-allyloxy-2-phenyl-ethyl)-2-amino-3H-purin-6-one CAS Name: 2-amino-7-(2-phenyl-2-prop-2-enoxyethyl)-3H-purin-6-one IUPAC Name: 2-amino-7-(2-phenyl-2-prop-2-enoxyethyl)-3H-purin-6-one Traditional Name: 7-(2-allyloxy-2-phenyl-ethyl)-2-amino-3H-purin-6-one Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(CN1C=NC2=C1C(=O)N=C(N2)N)C3=CC=CC=C3

Isomeric SMILES

C=CCOC(CN1C=NC2=C1C(=O)N=C(N2)N)C3=CC=CC=C3

InChI

InChI=1S/C16H17N5O2/c1-2-8-23-12(11-6-4-3-5-7-11)9-21-10-18-14-13(21)15(22)20-16(17)19-14/h2-7,10,12H,1,8-9H2,(H3,17,19,20,22)