bis[3-[5-cyano-2,4-bis(oxidanylidene)pyrimidin-1-yl]propyl]-methyl-azanium

Systemtic Name: bis[3-[5-cyano-2,4-bis(oxidanylidene)pyrimidin-1-yl]propyl]-methyl-azanium Openeye Name: bis[3-(5-cyano-2,4-dioxo-pyrimidin-1-yl)propyl]-methyl-ammonium CAS Name: bis[3-(5-cyano-2,4-dioxo-1-pyrimidinyl)propyl]-methylammonium IUPAC Name: bis[3-(5-cyano-2,4-dioxopyrimidin-1-yl)propyl]-methylazanium Traditional Name: bis[3-(5-cyano-2,4-diketo-pyrimidin-1-yl)propyl]-methyl-ammonium Formula: C17H20N7O4+ MolecularWeight: 386.3852

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCN1C=C(C(=O)NC1=O)C#N)CCCN2C=C(C(=O)NC2=O)C#N

Isomeric SMILES

C[NH+](CCCN1C=C(C(=O)NC1=O)C#N)CCCN2C=C(C(=O)NC2=O)C#N

InChI

InChI=1S/C17H19N7O4/c1-22(4-2-6-23-10-12(8-18)14(25)20-16(23)27)5-3-7-24-11-13(9-19)15(26)21-17(24)28/h10-11H,2-7H2,1H3,(H,20,25,27)(H,21,26,28)/p+1