1-(2-methoxyethyl)-3-phenyl-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 1-(2-methoxyethyl)-3-phenyl-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-1-(2-methoxyethyl)-3-phenyl-purine-2,6-dione CAS Name: 1-(2-methoxyethyl)-3-phenyl-7-prop-2-enylpurine-2,6-dione IUPAC Name: 1-(2-methoxyethyl)-3-phenyl-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-1-(2-methoxyethyl)-3-phenyl-xanthine Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(N=CN2CC=C)N(C1=O)C3=CC=CC=C3

Isomeric SMILES

COCCN1C(=O)C2=C(N=CN2CC=C)N(C1=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4O3/c1-3-9-19-12-18-15-14(19)16(22)20(10-11-24-2)17(23)21(15)13-7-5-4-6-8-13/h3-8,12H,1,9-11H2,2H3