azanium [(2Z)-1-(6-aminopurin-9-yl)-2-(3,4-dimethoxy-5-oxidanylidene-furan-2-ylidene)ethyl]-methoxy-phosphinate

Systemtic Name: azanium [(2Z)-1-(6-aminopurin-9-yl)-2-(3,4-dimethoxy-5-oxidanylidene-furan-2-ylidene)ethyl]-methoxy-phosphinate Openeye Name: ammonium [(2Z)-1-(6-aminopurin-9-yl)-2-(3,4-dimethoxy-5-oxo-2-furylidene)ethyl]-methoxy-phosphinate CAS Name: ammonium [(2Z)-1-(6-aminopurin-9-yl)-2-(3,4-dimethoxy-5-oxo-2-furanylidene)ethyl]-methoxyphosphinate IUPAC Name: azanium [(2Z)-1-(6-aminopurin-9-yl)-2-(3,4-dimethoxy-5-oxofuran-2-ylidene)ethyl]-methoxyphosphinate Traditional Name: ammonium [(2Z)-1-adenin-9-yl-2-(5-keto-3,4-dimethoxy-2-furylidene)ethyl]-methoxy-phosphinate Formula: C14H19N6O7P MolecularWeight: 414.310421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)OC1=CC(N2C=NC3=C2N=CN=C3N)P(=O)([O-])OC)OC.[NH4+]

Isomeric SMILES

COC\1=C(C(=O)O/C1=C\C(N2C=NC3=C2N=CN=C3N)P(=O)([O-])OC)OC.[NH4+]

InChI

InChI=1S/C14H16N5O7P.H3N/c1-23-10-7(26-14(20)11(10)24-2)4-8(27(21,22)25-3)19-6-18-9-12(15)16-5-17-13(9)19;/h4-6,8H,1-3H3,(H,21,22)(H2,15,16,17);1H3/b7-4-;