3-[2-[(8-aminocarbonyl-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methoxy]ethoxymethyl]-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide

Systemtic Name: 3-[2-[(8-aminocarbonyl-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methoxy]ethoxymethyl]-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide Openeye Name: 3-[2-[(8-carbamoyl-4-oxo-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methoxy]ethoxymethyl]-4-oxo-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide CAS Name: 3-[2-[(8-carbamoyl-4-oxo-3-imidazo[5,1-d][1,2,3,5]tetrazinyl)methoxy]ethoxymethyl]-4-oxo-8-imidazo[5,1-d][1,2,3,5]tetrazinecarboxamide IUPAC Name: 3-[2-[(8-carbamoyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methoxy]ethoxymethyl]-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide Traditional Name: 3-[2-[(8-carbamoyl-4-keto-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methoxy]ethoxymethyl]-4-keto-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide Formula: C14H14N12O6 MolecularWeight: 446.33776

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C2N1C(=O)N(N=N2)COCCOCN3C(=O)N4C=NC(=C4N=N3)C(=O)N)C(=O)N

Isomeric SMILES

C1=NC(=C2N1C(=O)N(N=N2)COCCOCN3C(=O)N4C=NC(=C4N=N3)C(=O)N)C(=O)N

InChI

InChI=1S/C14H14N12O6/c15-9(27)7-11-19-21-25(13(29)23(11)3-17-7)5-31-1-2-32-6-26-14(30)24-4-18-8(10(16)28)12(24)20-22-26/h3-4H,1-2,5-6H2,(H2,15,27)(H2,16,28)