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

Systemtic Name: ethyl 4-(4-oxidanylidene-7-pyridin-3-yl-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanoate Openeye Name: ethyl 4-[4-oxo-7-(3-pyridyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]butanoate CAS Name: 4-[4-oxo-7-(3-pyridinyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-oxo-7-pyridin-3-yl-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanoate Traditional Name: 4-[4-keto-7-(3-pyridyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]butyric acid ethyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=C1C(=O)N=CN2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=C1C(=O)N=CN2)C3=CN=CC=C3

InChI

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