4-(7-methyl-10-oxidanylidene-pyrimido[1,2-a]purin-1-yl)butyl ethanoate

Systemtic Name: 4-(7-methyl-10-oxidanylidene-pyrimido[1,2-a]purin-1-yl)butyl ethanoate Openeye Name: 4-(7-methyl-10-oxo-pyrimido[1,2-a]purin-1-yl)butyl acetate CAS Name: acetic acid 4-(7-methyl-10-oxo-1-pyrimido[1,2-a]purinyl)butyl ester IUPAC Name: 4-(7-methyl-10-oxopyrimido[1,2-a]purin-1-yl)butyl acetate Traditional Name: acetic acid 4-(10-keto-7-methyl-pyrimido[1,2-a]purin-1-yl)butyl ester Formula: C15H17N5O3 MolecularWeight: 315.32718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=O)C3=C(N=CN3CCCCOC(=O)C)N=C2N=C1

Isomeric SMILES

CC1=CN2C(=O)C3=C(N=CN3CCCCOC(=O)C)N=C2N=C1

InChI

InChI=1S/C15H17N5O3/c1-10-7-16-15-18-13-12(14(22)20(15)8-10)19(9-17-13)5-3-4-6-23-11(2)21/h7-9H,3-6H2,1-2H3