2-azanyl-9-[[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methylperoxy-[(E)-prop-1-enyl]phosphoryl]peroxymethyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methylperoxy-[(E)-prop-1-enyl]phosphoryl]peroxymethyl]-3H-purin-6-one Openeye Name: 2-amino-9-[[(2-amino-6-oxo-3H-purin-9-yl)methylperoxy-[(E)-prop-1-enyl]phosphoryl]peroxymethyl]-3H-purin-6-one CAS Name: 2-amino-9-[[(2-amino-6-oxo-3H-purin-9-yl)methyldioxy-[(E)-prop-1-enyl]phosphoryl]dioxymethyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[[(2-amino-6-oxo-3H-purin-9-yl)methylperoxy-[(E)-prop-1-enyl]phosphoryl]peroxymethyl]-3H-purin-6-one Traditional Name: 2-amino-9-[[(2-amino-6-keto-3H-purin-9-yl)methylperoxy-[(E)-prop-1-enyl]phosphoryl]peroxymethyl]-3H-purin-6-one Formula: C15H17N10O7P MolecularWeight: 480.332041

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Descriptors Computed from Structure

Canonical SMILES:

CC=CP(=O)(OOCN1C=NC2=C1NC(=NC2=O)N)OOCN3C=NC4=C3NC(=NC4=O)N

Isomeric SMILES

C/C=C/P(=O)(OOCN1C=NC2=C1NC(=NC2=O)N)OOCN3C=NC4=C3NC(=NC4=O)N

InChI

InChI=1S/C15H17N10O7P/c1-2-3-33(28,31-29-6-24-4-18-8-10(24)20-14(16)22-12(8)26)32-30-7-25-5-19-9-11(25)21-15(17)23-13(9)27/h2-5H,6-7H2,1H3,(H3,16,20,22,26)(H3,17,21,23,27)/b3-2+