ethyl 4-(6-cyclopropyl-7-iodanyl-4-oxidanylidene-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanoate

Systemtic Name: ethyl 4-(6-cyclopropyl-7-iodanyl-4-oxidanylidene-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanoate Openeye Name: ethyl 4-(6-cyclopropyl-7-iodo-4-oxo-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanoate CAS Name: 4-(6-cyclopropyl-7-iodo-4-oxo-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(6-cyclopropyl-7-iodo-4-oxo-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanoate Traditional Name: 4-(6-cyclopropyl-7-iodo-4-keto-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butyric acid ethyl ester Formula: C15H18IN3O3 MolecularWeight: 415.22619

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=C(C2=C1C(=O)N=CN2)I)C3CC3

Isomeric SMILES

CCOC(=O)CCCN1C(=C(C2=C1C(=O)N=CN2)I)C3CC3

InChI

InChI=1S/C15H18IN3O3/c1-2-22-10(20)4-3-7-19-13(9-5-6-9)11(16)12-14(19)15(21)18-8-17-12/h8-9H,2-7H2,1H3,(H,17,18,21)