9-[(1R,2R,3R,4R)-2,3-diethanoyl-4-(2-oxidanylidenepropyl)cyclopentyl]-3H-purin-6-one

Systemtic Name: 9-[(1R,2R,3R,4R)-2,3-diethanoyl-4-(2-oxidanylidenepropyl)cyclopentyl]-3H-purin-6-one Openeye Name: 9-[(1R,2R,3R,4R)-4-acetonyl-2,3-diacetyl-cyclopentyl]-3H-purin-6-one CAS Name: 9-[(1R,2R,3R,4R)-2,3-diacetyl-4-(2-oxopropyl)cyclopentyl]-3H-purin-6-one IUPAC Name: 9-[(1R,2R,3R,4R)-2,3-diacetyl-4-(2-oxopropyl)cyclopentyl]-3H-purin-6-one Traditional Name: 9-[(1R,2R,3R,4R)-4-acetonyl-2,3-diacetyl-cyclopentyl]-3H-purin-6-one Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1CC(C(C1C(=O)C)C(=O)C)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

CC(=O)C[C@H]1C[C@H]([C@@H]([C@@H]1C(=O)C)C(=O)C)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C17H20N4O4/c1-8(22)4-11-5-12(14(10(3)24)13(11)9(2)23)21-7-20-15-16(21)18-6-19-17(15)25/h6-7,11-14H,4-5H2,1-3H3,(H,18,19,25)/t11-,12+,13+,14-/m0/s1