4-[2-azanyl-4-(4-methoxyphenyl)-7-oxidanylidene-5H-pyrrolo[3,4-d]pyrimidin-6-yl]butanoic acid

Systemtic Name: 4-[2-azanyl-4-(4-methoxyphenyl)-7-oxidanylidene-5H-pyrrolo[3,4-d]pyrimidin-6-yl]butanoic acid Openeye Name: 4-[2-amino-4-(4-methoxyphenyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-6-yl]butanoic acid CAS Name: 4-[2-amino-4-(4-methoxyphenyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-6-yl]butanoic acid IUPAC Name: 4-[2-amino-4-(4-methoxyphenyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-6-yl]butanoic acid Traditional Name: 4-[2-amino-7-keto-4-(4-methoxyphenyl)-5H-pyrrolo[3,4-d]pyrimidin-6-yl]butyric acid Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3CN(C(=O)C3=NC(=N2)N)CCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3CN(C(=O)C3=NC(=N2)N)CCCC(=O)O

InChI

InChI=1S/C17H18N4O4/c1-25-11-6-4-10(5-7-11)14-12-9-21(8-2-3-13(22)23)16(24)15(12)20-17(18)19-14/h4-7H,2-3,8-9H2,1H3,(H,22,23)(H2,18,19,20)